1-[(아미녹시)메틸]-4-클로로벤센

O-[(4-chlorophenyl)methyl]hydroxylamine

HCID 217574

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 5555-51-1
표준 SMILES: NOCc1ccc(Cl)cc1
InChIKey: GONDHKVGJCQJPR-UHFFFAOYSA-N
분자식: C7H8ClNO
평균 분자량: 157.6 g/mol
단동위원소 질량: 157.0294416

이름 및 식별자

우선 이름: O-[(4-chlorophenyl)methyl]hydroxylamine
IUPAC: O-[(4-chlorophenyl)methyl]hydroxylamine
현지명: 1-[(아미녹시)메틸]-4-클로로벤센
영어명: 1-[(AMINOOXY)METHYL]-4-CHLOROBENZENE
분자식: C7H8ClNO
분자량: 157.6

이름 및 동의어

5555-51-1O-[(4-chlorophenyl)methyl]hydroxylamineO-((4-Chlorophenyl)methyl)hydroxylamineRefChem:855063879-052-91-[(Aminooxy)methyl]-4-chlorobenzeneO-(4-chlorobenzyl)hydroxylamineHydroxylamine, O-[(4-chlorophenyl)methyl]-MFCD04230620CHEMBL3764023SCHEMBL1520291SCHEMBL8716806

이름 더 보기

1-[(아미녹시)메틸]-4-클로로벤센(4-chlorobenzyl)oxyamine-[(aminooxy)methyl]-4-chlorobenzene1-[(aminooxy)methyl]-4-chlorobenzene(SALTDATA: FREE)

CHEMBL3765978SCHEMBL11167734DTXSID50902722GONDHKVGJCQJPR-UHFFFAOYSA-NFAA55551BDBM50146529EBC-44094AKOS000353333

데이터베이스 식별자

CAS: 5555-51-1
PubChem CID: 217574
DTXSID: DTXSID50902722
ChEMBL: CHEMBL3764023、CHEMBL3765978
EC Number: 879-052-9
Nikkaji: J238.973H

물성

구조 계산 물성

XLogP: 1.8
극성 표면적: 35.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 10
형식 전하: 0
복잡도: 91

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, 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.