HCID18329455

4-(3-Bromophenyl)butanoic acid

C10H11BrO2243.1 g/molCAS 899350-32-4

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IDENTITY

结构与身份

标准SMILES: O=C(O)CCCc1cccc(Br)c1
InChIKey: MJSLVHKDBWJPCL-UHFFFAOYSA-N
分子式: C10H11BrO2
平均分子量: 243.1 g/mol
单同位素质量: 241.99424

COMPUTED

结构计算性质

已同步

XLogP: 2.7
极性表面积: 37.3 Å²
氢键供体: 1
氢键受体: 2
可旋转键: 4
重原子: 13
形式电荷: 0
复杂度: 170

GHS

GHS分类

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

Hazard Classes and Categories

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

ALIASES

名称与别名

共 26 条

4-(3-bromophenyl)butanoic acid899350-32-4DTXSID80592857RefChem:287564DTXCID20543621888-864-23-bromoBenzenebutanoic acid3-Bromo-benzenebutanoic AcidBENZENEBUTANOIC ACID, 3-BROMO-4-(3-BROMO-PHENYL)-BUTYRIC ACIDMFCD068104954-(3-Bromophenyl)butanoicacid4-(3-bromophenyl)butyric acidSCHEMBL1445967MJSLVHKDBWJPCL-UHFFFAOYSA-NAKOS005265050CS-W021989DS-2811SB39714AC-25647

REACTIONS