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1,3-Hexanediol, 2-(methylamino)- | 1822540-33-9

中文名称
——
中文别名
——
英文名称
1,3-Hexanediol, 2-(methylamino)-
英文别名
2-(methylamino)hexane-1,3-diol
1,3-Hexanediol, 2-(methylamino)-化学式
CAS
1822540-33-9
化学式
C7H17NO2
mdl
——
分子量
147.22
InChiKey
IYRZEUCKJCKYGK-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    -0.2
  • 重原子数:
    10
  • 可旋转键数:
    5
  • 环数:
    0.0
  • sp3杂化的碳原子比例:
    1.0
  • 拓扑面积:
    52.5
  • 氢给体数:
    3
  • 氢受体数:
    3

文献信息

  • OIL-IN-WATER EMULSIFIED COSMETIC COMPOSITION
    申请人:YAMAMOTO Yumiko
    公开号:US20100311836A1
    公开(公告)日:2010-12-09
    The present invention relates to an oil-in-water emulsified cosmetic composition, which contains an emulsion having (A) a sphingosine represented by formula (1), (B) an acid compound selected from inorganic acids and organic acids having 5 or less carbon atoms, and (C) a ceramide represented by formula (2); and another emulsion having (D) an oil component selected from polar oils and hydrocarbon oils, and (E) a surfactant. (wherein, R 1 represents a hydrocarbon group which may have a substituent; Y represents methylene, methine or O; X 1 , X 2 and X 3 each represent H, OH or acetoxy group; X 4 represents H, acetyl group or the like; R 2 and R 3 each represents H, OH or the like; R represents H, amidino group or the like; and a stands for 2 or 3) (wherein, R 7 represents a hydrocarbon group which may have a substituent, or H; Z represents methylene, methine or O; X 5 , X 6 and X 7 each represent H, OH or acetoxy group; X 4 represents H, acetyl group or the like; R 8 and R 9 each represent H, OH or the like; R 10 represents a hydrocarbon group which may have a substituent; and R 11 represents H or a hydrocarbon group which may have a substituent). The oil-in-water emulsified cosmetic composition contains a ceramide and is excellent in emulsion stability.
  • Reverse Vesicle
    申请人:Okubo Koji
    公开号:US20110263714A1
    公开(公告)日:2011-10-27
    The reverse vesicle composition of the present invention includes (A) a sphingosine represented by formula (1) (wherein R 1 represents a C4 to C30 linear alkyl group which may be substituted by a hydroxyl group, a carbonyl group, or an amino group; Y represents a methylene group, a methine group, or an oxygen atom; each of X 1 , X 2 , and X 3 represents a hydrogen atom, a hydroxyl group, or an acetoxy group; X 4 represents a hydrogen atom, an acetyl group, or a glyceryl group, or forms an oxo group together with the adjacent oxygen atom (wherein when Y is a methine group, one of X 1 and X 2 is a hydrogen atom, and the other is absent, and when X 4 forms an oxo group, X 3 is absent); each of R 2 and R 3 represents a hydrogen atom, a hydroxyl group, a hydroxymethyl group, or an acetoxymethyl group; a is a number of 2 or 3; each of (R) a represents a hydrogen atom, an amidino group, or a linear-chain alkyl group optionally having a substituent selected from among a hydroxyl group, a hydroxyalkoxy group, an alkoxy group, and an acetoxy group and containing 1 to 8 carbon atoms in total; and the broken line represents an optional unsaturated bond), (B) a C16 to C30 fatty acid, (C) a hydrocarbon oil, (D) an ester oil which is in liquid form at 25° C., and (F) water, wherein the ratio by mass of ingredient (C) to ingredient (D) satisfies the following relationship: 1≦(C)/(D)<1000, and the composition contains a surfactant having a molecular weight of 1,000 or less in an amount of 1 mass % or less.
  • EMULSIFIED COMPOSITION
    申请人:Orita Masanori
    公开号:US20120108661A1
    公开(公告)日:2012-05-03
    The emulsion composition of the present invention contains (A) 0.001 to 10 wt. % of an organic compound having two or more hydroxyl groups, an inorganic value of 220 to 450, and an organic value of 300 to 1,000; (B) 0.001 to 10 wt. % of an organic compound having one hydroxyl group, an inorganic value of 100 to 200, and an organic value of 280 to 700; (C) 0.001 to 10 wt. % of a compound represented by formula (2): wherein R 1 is a C4 to C30 hydrocarbon group; Z is a methylene group, a methine group, or an oxygen atom; X 1 , X 2 , X 3 is a hydrogen atom, a hydroxyl group, or an acetoxy group; X 4 is a hydrogen atom, an acetyl group, or a glyceryl group; each of R 2 and R 3 a hydrogen atom, a hydroxyl group, a hydroxymethyl group, or an acetoxymethyl group; R 4 is a C5 to C60 hydrocarbon group; and R 5 is a hydrogen atom or a hydrocarbon group containing 1 to 30 carbon atoms in total; (D) 0.00012 to 10 wt. % of at least one compound selected from the group consisting of a nonionic surfactant having a polyoxyethylene group and an HLB of 10 or higher, an ionic surfactant, and a sphingosine salt; (E) 0.003 to 15 wt. % of at least one compound selected from the group consisting of a sugar alcohol selected from the group consisting of erythritol, threitol, xylitol, and mannitol, a disaccharide, and a trisaccharide; and (F) water.
  • OIL-BASED COMPOSITION
    申请人:Okubo Koji
    公开号:US20120295989A1
    公开(公告)日:2012-11-22
    A method for producing a gel-like oily composition including the following components (A), (B), and (C): (A) 4 to 60% by weight of a sphingosine represented by the formula (1) (wherein R 1 represents a hydrocarbon group having 4 to 30 carbon atoms; Y represents a methylene group, a methine group, or an oxygen atom; X 1 , X 2 , and X 3 each represent a hydrogen atom, a hydroxyl group, or an acetoxy group; X 4 represents a hydrogen atom, an acetyl group, or a glyceryl group or forms an oxo group together with the adjacent oxygen atom; R 2 and R 3 each represent a hydrogen atom, a hydroxyl group, a hydroxymethyl group, or an acetoxymethyl group; “R”s each represent a hydrogen atom or an amidino group or represent a hydrocarbon group having a total of 1 to 8 carbon atoms; “a” represents a number of 2 or 3; and a bond represented by a broken line and a solid line indicates a saturated bond or an unsaturated bond); (B) 0.5 to 10% by weight of an anionic polymer having a carboxyl group; and (C) 30 to 95.5% by weight of an oil in a liquid state at 25° C. selected from a hydrocarbon oil, an ester oil, and an ether oil, the method including mixing the components (A), (B), and (C) and heating the resultant mixture to a temperature equal to or more than a melting point of the component (A) to neutralize the component (B) with the component (A) to form a salt.
  • VESICLE COMPOSITION
    申请人:Yamamoto Yumiko
    公开号:US20140018443A1
    公开(公告)日:2014-01-16
    The present invention is to provide a vesicle composition comprising the following components (A), (B) and (C): (A) 0.0001 to 20 mass % of an organic acid represented by general formula (1): wherein R 1 represents a natural sterin having a single hydroxy group or a hydrogenated product thereof or a residue which remains after a hydrogen atom is removed from the hydroxy group of bile acid, R 2 represents a divalent hydrocarbon group having 1 to 24 carbon atoms, M represents a hydrogen atom, an alkali metal, an alkali earth metal, ammonium, an alkanolammonium having 2 to 9 carbon atoms in total, an alkylammonium or alkenylammonium having 1 to 22 carbon atoms in total, pyridinium substituted with an alkyl group or alkenyl group having 1 to 18 carbon atoms or a basic amino acid, (B) 0.0001 to 10 mass % of a sphingosine, and (C) water, and having a pH of 2 to 11.
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