(2-Isocyanatocyclopropyl)benzene

HCID 582709CAS 63006-15-5

基本情報

標準SMILES: O=C=NC1CC1c1ccccc1
InChIKey: DYUXVJAFBUZREW-UHFFFAOYSA-N
分子式: C10H9NO
平均分子量: 159.18 g/mol
単同位体質量: 159.06841391

名称と識別子

優先名称: (2-Isocyanatocyclopropyl)benzene
IUPAC: (2-isocyanatocyclopropyl)benzene

名称と別名

(2-Isocyanatocyclopropyl)benzene63006-15-5RefChem:395938827-303-863009-74-5SCHEMBL134488DYUXVJAFBUZREW-UHFFFAOYSA-NAKOS009158374DB-054370DB-344593NS00029760EN300-81047

名称をさらに表示

Z1094720198

データベース識別子

CAS: 63006-15-5
PubChem CID: 582709
EC Number: 827-303-8

物性

構造計算による物性

XLogP: 2.9
極性表面積: 29.4 Å²
水素結合供与体数: 0
水素結合受容体数: 2
回転可能結合数: 2
重原子数: 12
形式電荷: 0
複雑度: 202

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H331 (100%): Toxic if inhaled [Danger Acute toxicity, inhalation]；H334 (100%): May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory]；H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P233, P260, P261, P264, P270, P271, P272, P273, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P333+P317, P342+P316, P362+P364, P363, P391, P403, 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.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Corr. 1B (100%)；Skin Sens. 1 (100%)；Acute Tox. 3 (100%)；Resp. Sens. 1 (100%)；Aquatic Chronic 2 (100%)