1-Bromo-2-isothiocyanatobenzene

HCID 611654

基本情報

CAS
13037-60-0
標準SMILES
S=C=Nc1ccccc1Br
InChIKey
PAFORXDSYWMYGP-UHFFFAOYSA-N
分子式
C7H4BrNS
平均分子量
214.08 g/mol
単同位体質量
212.92478

名称と識別子

優先名称
1-Bromo-2-isothiocyanatobenzene
IUPAC
1-bromo-2-isothiocyanatobenzene
英語名
bromoisothiocyanatobenzene
分子式
C7H4BrNS
分子量
214.08236

名称と別名

13037-60-01-Bromo-2-isothiocyanatobenzeneDTXSID00156495RefChem:430301DTXCID2078986626-134-52-Bromophenyl isothiocyanate2-BromophenylisothiocyanateBenzene, 1-bromo-2-isothiocyanato-MFCD000047991-bromo-2-isothiocyanato-benzeneIsothiocyanic Acid 2-Bromophenyl Ester
名称をさらに表示
BromoisothiocyanatobenzeneBenzene, bromoisothiocyanato-64217-61-4o-bromophenyl isothiocyanateSCHEMBL1022261SCHEMBL305076071-Bromo-2-isothiocyanatobenzene #2-Bromophenyl isothiocyanate, 98%

データベース識別子

CAS
13037-60-0、64217-61-4
PubChem CID
611654
DTXSID
DTXSID00156495
EC Number
264-732-4、626-134-5
Nikkaji
J1.470.910J

物性

構造計算による物性

XLogP
4
極性表面積
44.5 Ų
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
1
重原子数
10

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (97.9%): Harmful in contact with skin [Warning Acute toxicity, dermal];H314 (12.8%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation];H315 (87.2%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (87.2%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (91.5%): Harmful if inhaled [Warning Acute toxicity, inhalation];H334 (87.2%): May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory];H335 (89.4%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P233, P260, P261, P264, P264+P265, P270, P271, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P342+P316, P362+P364, P363, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 7 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 CategoriesAcute Tox. 4 (100%);Acute Tox. 4 (97.9%);Skin Corr. 1B (12.8%);Skin Irrit. 2 (87.2%);Eye Irrit. 2 (87.2%);Acute Tox. 4 (91.5%);Resp. Sens. 1 (87.2%);STOT SE 3 (89.4%)

化学と産業

サプライヤー80 社

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
湖南韵邦生物科技股份有限公司85561037 15386497078 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

関連反応

8 件

化合物ノート

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