HCID819083

(alphaS)-alpha-Amino-3-thiophenepropanoic acid

(2S)-2-amino-3-thiophen-3-ylpropanoic acid

C7H9NO2S171.22 g/molCAS 3685-51-6

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IDENTITY

结构与身份

标准SMILES: N[C@@H](Cc1ccsc1)C(=O)O
InChIKey: VOIZSAUUYAGTMS-LURJTMIESA-N
分子式: C7H9NO2S
平均分子量: 171.22 g/mol
单同位素质量: 171.0353997

COMPUTED

结构计算性质

已同步

XLogP: -1.7
极性表面积: 91.6 Å²
氢键供体: 2
氢键受体: 4
可旋转键: 3
重原子: 11
形式电荷: 0
复杂度: 151

GHS

GHS分类

来源：PubChem

GHS Classification

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

HAZARDS

危害信息

来源：PubChem

Hazard Classes and Categories

Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)

ALIASES

名称与别名

共 41 条

3685-51-63-(3-thienyl)-l-alanineA8M2770HBCbeta-3-Thienyl-L-alanineUNII-A8M2770HBC.BETA.-3-THIENYL-L-ALANINE(alphaS)-alpha-Amino-3-thiophenepropanoic acid3-Thiophenepropanoic acid, alpha-amino-, (alphaS)-(.ALPHA.S)-.ALPHA.-AMINO-3-THIOPHENEPROPANOIC ACID3-THIOPHENEPROPANOIC ACID, .ALPHA.-AMINO-, (.ALPHA.S)-RefChem:196534L-3-Thienylalanine(S)-2-Amino-3-(thiophen-3-yl)propanoic acidMFCD00038645(2S)-2-amino-3-thiophen-3-ylpropanoic acidL-3-(3-Thienyl)alanine(2S)-2-amino-3-(thiophen-3-yl)propanoic acidss-3-ThienylalaninH-3-Thi-OHH-Ala(3-Thienyl)-OH

REACTIONS

参与反应

2 条

全部作为反应物作为生成物作为试剂作为催化剂作为溶剂

HRID260218

uspto-grants-1996_06

作为反应物

uspto-grants-1996_06 · 10.6084/m9.figshare.5104873.v1 · US05525723

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HRID1683344

uspto-grants-1997_06

作为反应物

uspto-grants-1997_06 · 10.6084/m9.figshare.5104873.v1 · US05637698

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