6-ヒドロキシカプロン酸

6-Hydroxyhexanoic Acid

HCID 14490
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基本情報

CAS
1191-25-9
標準SMILES
O=C(O)CCCCCO
InChIKey
IWHLYPDWHHPVAA-UHFFFAOYSA-N
分子式
C6H12O3
平均分子量
132.16 g/mol
単同位体質量
132.07864424

名称と識別子

優先名称
6-Hydroxyhexanoic Acid
IUPAC
6-hydroxyhexanoic acid
現地名
6-ヒドロキシカプロン酸
英語名
6-Hydroxycaproic acid
分子式
C6H12O3
分子量
132.16

名称と別名

6-Hydroxyhexanoic acid1191-25-9Hexanoic acid, 6-hydroxy-epsilon-Hydroxycaproic acid3Y3OX37NM85-hydroxypentanecarboxylic acidCHEBI:17869DTXSID00152316RefChem:104785DTXCID40748076-HYDROXYCAPROIC ACIDMFCD00046560
名称をさらに表示
6-ヒドロキシヘキサン酸6-ヒドロキシカプロン酸ε-ヒドロキシカプロン酸6-hydroxyhexanoateNSC 6173198-Hydroxyhexanoic acid6-Hydroxycaproic acid,95%6-Hydroxycaproic Acid,Contains Lactone6-Hydroxycaproicacid,pract.,containslactone
6-hydroxy caproic acid6-hydroxy-hexanoic acid5-carboxypentanolUNII-3Y3OX37NM86-hydroxy-caproic acid6-Hydroxyhexanoic acid #Hexanoic acid,6-hydroxy-6-HYDROCAPROIC ACID

データベース識別子

CAS
1191-25-9
PubChem CID
14490
DTXSID
DTXSID00152316
ChEMBL
CHEMBL2006530
ChEBI
CHEBI:17869
UNII
3Y3OX37NM8
EC Number
681-173-5
Nikkaji
J262.001D

物性

構造計算による物性

XLogP
-0.4
極性表面積
57.5 Ų
水素結合供与体数
2
水素結合受容体数
3
回転可能結合数
5
重原子数
9

実験および物理化学的性質

Physical DescriptionSolid
Kovats Retention Index2540.1

物理化学的性質

融点
38 · 38-40 °C
沸点
113 · 113-116 °C
比重(密度)
0.981 · 0.981
屈折率
1.44 · 1.44
闪点
110 °C · >110°C
貯蔵温度
-20 °C · Sealed in dry,Store in freezer, under -20°C

化学的性質

化学的特性white low melting crystalline solid

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H228 (14.3%): Flammable solid [Danger Flammable solids]；H314 (14.3%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H315 (85.7%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (85.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (71.4%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P210, P240, P241, P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, P370+P378, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 7 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

危険有害性情報

Hazard Classes and CategoriesSkin Irrit. 2 (85.7%)；Eye Irrit. 2 (85.7%)

安全データ

ridadr
UN 1760 8/PG 2
hs_code
29181998
risk_code
34
hazard_code
C
safety_code
24/25-45-36/37/39-26-23

化学と産業

応用分野

使用6-Hydroxyhexanoic acid acts as a useful reagent in synthetic chemistry. It is used as a precursor to prepare surface active monomers.

上流・下流製品情報

サプライヤー97 社

上海康恩博医药科技有限公司17510465506 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

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