4-Acetamidobenzenesulfonyl azide

HCID 5129185CAS 2158-14-7

基本情報

標準SMILES: CC(=O)Nc1ccc(S(=O)(=O)N=[N+]=[N-])cc1
InChIKey: NTMHWRHEGDRTPD-UHFFFAOYSA-N
分子式: C8H8N4O3S
平均分子量: 240.24 g/mol

名称と識別子

優先名称: 4-Acetamidobenzenesulfonyl azide
IUPAC: N-(4-azidosulfonylphenyl)acetamide

名称と別名

4-Acetamidobenzenesulfonyl azide2158-14-7DTXSID10408598RefChem:97602DTXCID10359450606-801-7N-(4-azidosulfonylphenyl)acetamidep-ABSA4-acetamidophenylsulfonyl azide4-acetamidobenzene-1-sulfonyl azide4-(acetylamino)benzenesulfonyl azide4-acetamidobenzenesulfonylazide

名称をさらに表示

MFCD00029626p-acetamidobenzenesulfonyl azideNSC 82543NSC-825434-Acetamidobenzenesulfonyl azide; 4-Acetamidophenylsulfonyl azide; N-(4-Azidosulfonylphenyl)acetamide; NSC 82543;4-Acetamidobenzene sulfonyl azide4-Acetamidophenyl sulphonyl azideN-Acetylsulfanilyl Azide; 4-(Acetylamino)benzenesulfonyl Azide; 4-Acetamidobenzenesulfonyl Azide; NSC 82543; p-Acetamidobenzenesulfonyl Azide

データベース識別子

CAS: 2158-14-7
PubChem CID: 5129185
DTXSID: DTXSID10408598
UNII: HFH5H2MX8S
EC Number: 606-801-7
Nikkaji: J1.396.154I

物性

構造計算による物性

XLogP: 1.8
極性表面積: 86 Å²
水素結合供与体数: 1
水素結合受容体数: 5
回転可能結合数: 3
重原子数: 16
形式電荷: 0
複雑度: 399

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/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)

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.