(1S,2S)-2-[(4R,11BS)-3,5-二氢-4H-二萘并[2,1-C:1',2'-E〕膦-4-基]-1,2-二苯基乙胺 | 1092064-02-2

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二苯乙烯类
• 中文名称: (1S,2S)-2-[(4R,11BS)-3,5-二氢-4H-二萘并[2,1-C:1',2'-E〕膦-4-基]-1,2-二苯基乙胺
• 中文别名: (1S,2S)-2-[(4R,11BS)-3H-二萘并[2,1-C:1',2'-E]亚磷-4(5H)-基]-1,2-二苯基乙基胺, 97+%
• 英文名称: (1S,2S)-2-((S)-3H-dinaphtho[2,1-c:1',2'-e]phosphepin-4(5H)-yl)-1,2-diphenyl-ethanamine
• 英文别名: (1S,2S)-2-((4S)-3H-Dinaphtho[2,1-c:1',2'-e]phosphepin-4(5H)-yl)-1,2-diphenylethanamine；(1S,2S)-1,2-diphenyl-2-(13-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-13-yl)ethanamine
• CAS: 1092064-02-2
• 化学式: C₃₆H₃₀NP
• 分子量: 507.615
• InChiKey: YHBAPPMVVCHAQC-ZPGRZCPFSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.2
• 重原子数：
  38
• 可旋转键数：
  4
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  26
• 氢给体数：
  1
• 氢受体数：
  1

SDS

---

Section 1: Product Identification
(1S,2S)-2-[(4R,11bS)-3,5-dihydro-4H-dinaphtho[2,1-c:1',2'-e]phosphepin-4-yl]-1,2-diphenylethanamine, min.
Chemical Name:
97%
CAS Registry Number: 1092064-02-2
Formula: C36H30NP
EINECS Number: none
Chemical Family: organophosphine ligand
Synonym: none

---

Section 2: Composition and Information on Ingredients
Ingredient CAS Number Percent ACGIH (TWA) OSHA (PEL)
Title compound 1092064-02-2 100% no data no data

---

Section 3: Hazards Identification
Emergency Overview: Irritating to skin, eyes and respiratory tract. May be harmful if swallowed.
Primary Routes of Exposure: Ingestion, inhalation
Eye Contact: Causes moderate irritation of the eyes.
Skin Contact: Causes slight to mild irritation of the skin.
Inhalation: Irritating to the nose, mucous membranes and respiratory tract.
Ingestion: No information available on the physiological effects of ingestion. May be harmful if swallowed.
Acute Health Affects: Irritating to skin, eyes and respiratory tract.
Chronic Health Affects: No information on long-term chronic effects.
NTP: No
IARC: No
OSHA: No

---

SECTION 4: First Aid Measures
Immediately flush the eyes with copious amounts of water for at least 10-15 minutes. A victim may need
Eye Exposure:
assistance in keeping their eye lids open. Get immediate medical attention.
Wash the affected area with water. Remove contaminated clothes if necessary. Seek medical assistance if
Skin Exposure:
irritation persists.
Remove the victim to fresh air. Closely monitor the victim for signs of respiratory problems, such as difficulty
Inhalation:
in breathing, coughing, wheezing, or pain. In such cases seek immediate medical assistance.
Seek medical attention immediately. Keep the victim calm. Give the victim water (only if conscious). Induce
Ingestion:
vomiting only if directed by medical personnel.

---

SECTION 5: Fire Fighting Measures
Flash Point: no data
Autoignition Temperature: no data
Explosion Limits: no data
Extinguishing Medium: carbon dioxide, dry powder or foam
If this product is involved in a fire, fire fighters should be equipped with a NIOSH approved positive pressure
Special Fire Fighting Procedures:
self-contained breathing apparatus and full protective clothing.
Hazardous Combustion and If involved in a fire this material may emit irritating fumes.
Decomposion Products:
Unusual Fire or Explosion Hazards: No unusual fire or explosion hazards.

---

SECTION 6: Accidental Release Measures
Spill and Leak Procedures: Small spills can be mixed with vermiculite or sodium carbonate and swept up.

---

SECTION 7: Handling and Storage
Store in a tightly sealed container under an inert atmosphere of nitrogen or argon. Keep in a cool, dry, well
Handling and Storage:
ventilated place.

---

SECTION 8: Exposure Controls and Personal Protection
Eye Protection: Always wear approved safety glasses when handling a chemical substance in the laboratory.
Skin Protection: Wear protective clothing and gloves.
Ventilation: Handle the material in an efficient fume hood.
If ventilation is not available a respirator should be worn. The use of respirators requires a Respirator
Respirator:
Protection Program to be in compliance with 29 CFR 1910.134.
Ventilation: Handle the material in an efficient fume hood.
Additional Protection: No additional protection required.

---

SECTION 9: Physical and Chemical Properties
Color and Form: white solid
Molecular Weight: 507.6
Melting Point: no data
Boiling Point: no data
Vapor Pressure: no data
Specific Gravity: no data
Odor: none
Solubility in Water: Insoluble

---

SECTION 10: Stability and Reactivity
Stability: air sensitive
Hazardous Polymerization: no hazardous polymerization
Conditions to Avoid: prolonged exposure to air
Incompatibility: strong oxidizing agents
Decomposition Products: carbon monoxide, carbon dioxide, nitrogen oxides, phosphorous oxides and organic fumes

---

SECTION 11: Toxicological Information
RTECS Data: No information available in the RTECS files
Carcinogenic Effects: No data
Mutagenic Effects: No data
Tetratogenic Effects: No data

---

SECTION 12: Ecological Information
Ecological Information: No information available

---

SECTION 13: Disposal Considerations
Disposal: Dispose of according to local, state and federal regulations.

---

SECTION 14: Transportation
Shipping Name (CFR): Non-hazardous
Hazard Class (CFR): NA
Additional Hazard Class (CFR): NA
Packaging Group (CFR): NA
UN ID Number (CFR): NA
Shipping Name (IATA): Non-hazardous
Hazard Class (IATA): NA
Additional Hazard Class (IATA): NA
Packaging Group (IATA): NA
UN ID Number (IATA): NA

---

SECTION 15: Regulatory Information
TSCA: Not listed in the TSCA inventory
SARA (Title 313): Not reportable under SARA 313.
Second Ingredient: none

---

SECTION 16 - ADDITIONAL INFORMATION
N/A

反应信息

• 作为反应物：
  描述：

  (1S,2S)-2-[(4R,11BS)-3,5-二氢-4H-二萘并[2,1-C:1',2'-E〕膦-4-基]-1,2-二苯基乙胺 在 tetrafluoroboric acid 作用下， 以 二氯甲烷 、 水 为溶剂， 反应 0.5h， 以59%的产率得到(1S,2S)-2-((4R,11bS)-3H-dinaphtho[2,1-c:1',2'-e]phosphepin-4(5H)-yl)-1,2-diphenylethanammonium tetrafluoroborate
  参考文献：
  名称：

  METHOD FOR PREPARING A METAL CATALYST

  摘要：

  本公开涉及一种制备金属催化剂的方法，该方法包括至少一种通过至少一个磷（P）原子和至少一个氮（N）原子配位到金属的配体，所述方法包括在碱的存在下，将金属前体配合物与氨基膦、二氨基膦、氨基双膦或二氨基双膦的酸和盐反应。

  公开号：

  US20120046479A1
• 作为产物：
  描述：

  tert-butyl N-[(1S,2S)-1,2-diphenyl-2-(13-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-13-yl)ethyl]carbamate 在 三氟乙酸 、 sodium carbonate 作用下， 以 二氯甲烷 、 水 为溶剂， 以72%的产率得到(1S,2S)-2-[(4R,11BS)-3,5-二氢-4H-二萘并[2,1-C:1',2'-E〕膦-4-基]-1,2-二苯基乙胺
  参考文献：
  名称：

  [EN] METHOD FOR THE PREPARATION OF AMINOPHOSPHINE LIGANDS AND THEIR USE IN METAL CATALYSTS
  [FR] PROCÉDÉ D'OBTENTION DE LIGANDS DE TYPE AMINOPHOSPHINE ET LEUR UTILISATION COMME CATALYSEURS MÉTALLIQUES

  摘要：

  公开号：

  WO2008148202A8

文献信息

• Rhodium-P,O-bidentate coordinated ureaphosphine ligands for asymmetric hydrogenation reactions
  作者：Jurjen Meeuwissen、Remko J. Detz、Albertus J. Sandee、Bas de Bruin、Joost N. H. Reek

  DOI：10.1039/b926043a

  日期：——

  We present new ureaphosphine ligands that coordinate in a P,O-bidentate fashion to rhodium(I). The ureaphosphine-Rh(I)-complexes were effectively used in the asymmetric hydrogenation of cyclic enamides giving high conversions and enantioselectivity.

  我们提出新的 脲膦以P，O-二齿形式与铑（I）配位的配体。这脲膦-Rh（I）-配合物可有效用于环状酰胺的不对称氢化，从而提供高转化率和对映选择性。
• [EN] METHOD FOR THE PREPARATION OF AMINOPHOSPHINE LIGANDS AND THEIR USE IN METAL CATALYSTS<br/>[FR] PROCÉDÉ D'OBTENTION DE LIGANDS DE TYPE AMINOPHOSPHINE ET LEUR UTILISATION COMME CATALYSEURS MÉTALLIQUES
  申请人：KANATA CHEMICAL TECHNOLOGIES I

  公开号：WO2008148202A8

  公开（公告）日：2009-07-23
• METHOD FOR THE PREPARATION OF AMINOPHOSPHINE LIGANDS AND THEIR USE IN METAL CATALYSTS
  申请人：Abdur-Rashid Kamaluddin

  公开号：US20100204514A1

  公开（公告）日：2010-08-12

  The present application is directed to i) a method for synthesizing aminophosphine (P,N) and phosphine-aminophosphine (P,N,P) ligands, ii) the use of such ligands in the preparation of metal complexes as hydrogenation catalysts, and iii) aminophosphine (P,N) and phosphine-aminophosphine (P,N,P) ligands of various structures. In particular, the methods in i) involve reacting a protected tertiary amine of formula (I) with a metal phosphide of the formula Y—PR8R9 to afford an aminophosphine of formula (II), which can then be optionally further reacted with a phosphine of the formula (III) to afford the phosphine-aminophosphine of formula (IV).
• US8658825B2
  申请人：——

  公开号：US8658825B2

  公开（公告）日：2014-02-25
• US8716508B2
  申请人：——

  公开号：US8716508B2

  公开（公告）日：2014-05-06