HCID13102401

((4-Phenylbutyl)hydroxyphosphoryl)acetic acid

2-[hydroxy(4-phenylbutyl)phosphoryl]acetic acid

C12H17O4P256.23 g/molCAS 83623-61-4

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IDENTITY

结构与身份

标准SMILES: O=C(O)CP(=O)(O)CCCCc1ccccc1
InChIKey: WRXLMKMDSUIHDK-UHFFFAOYSA-N
分子式: C12H17O4P
平均分子量: 256.23 g/mol
单同位素质量: 256.08644602

COMPUTED

结构计算性质

已同步

XLogP: 1.2
极性表面积: 74.6 Å²
氢键供体: 2
氢键受体: 4
可旋转键: 7
重原子: 17
形式电荷: 0
复杂度: 284

GHS

GHS分类

来源：PubChem

GHS Classification

Danger

H317: May cause an allergic skin reaction [Warning Sensitization, Skin]；H318: Causes serious eye damage [Danger Serious eye damage/eye irritation]；H373 **: May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]

P260, P261, P264+P265, P272, P280, P302+P352, P305+P354+P338, P317, P319, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)

Danger

HAZARDS

危害信息

来源：PubChem

Regulatory Information

Status: Active Update: 15-12-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/2547

Hazard Classes and Categories

Skin Irrit. 2 (100%)；Skin Sens. 1 (100%)；Eye Dam. 1 (100%)；STOT SE 3 (100%)；STOT RE 2 (100%)

Skin Sens. 1 (100%)；Eye Dam. 1 (100%)；STOT RE 2 (100%)

Specific target organ toxicity (repeated exposure) - category 2；Eye damage - category 1；Skin sensitisation - category 1

STOT RE 2 *；Eye Dam. 1；Skin Sens. 1

REGULATORY

法规信息

来源：PubChem

Regulatory Information

Status: Active Update: 15-12-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/2547

ALIASES

名称与别名

共 24 条

((4-Phenylbutyl)hydroxyphosphoryl)acetic acidEC 412-170-72-[Hydroxy(4-phenylbutyl)phosphinyl]acetic acid2-(Hydroxy(4-phenylbutyl)phosphinyl)acetic acidRefChem:390228412-170-783623-61-42-[hydroxy(4-phenylbutyl)phosphoryl]acetic acid4-Phenybutyl 2-Carboxyethylphosphinic Acid (Fosinopril Impurity A)[Hydroxy(4-phenylbutyl)phosphinyl]acetic Acid4-Phenybutyl 2-Carboxyethylphosphinic AcidAC-7633JZ6U8XS6PAAcetic acid, 2-[hydroxy(4-phenylbutyl)phosphinyl]-SCHEMBL7379076DTXSID90518220AKOS015967055IP26897Hydroxyl(4-phenylbutyl)phosphinyl]aceticacidNS00008505

REACTIONS