CAS 29601-98-7 N-benzylhydroxylamine hydrochloride (HCID 11332622)

기본 정보

CAS: 29601-98-7
표준 SMILES: Cl.ONCc1ccccc1
InChIKey: YSNXOQGDHGUKCZ-UHFFFAOYSA-N
분자식: C7H10ClNO
평균 분자량: 159.61 g/mol
단동위원소 질량: 159.04509162

이름 및 식별자

우선 이름: N-benzylhydroxylamine hydrochloride
IUPAC: N-benzylhydroxylamine;hydrochloride
영어명: N-Benzylhydroxylamine hydrochloride
분자식: C7H10ClNO
분자량: 159.61

이름 및 동의어

N-Benzylhydroxylamine hydrochloride29601-98-7Benzenemethanamine, N-hydroxy-, hydrochlorideDTXSID30462571RefChem:829239DTXCID20413390629-276-6N-Benzylhydroxylamine HClMFCD00043377Benzenemethanamine, N-hydroxy-, hydrochloride (1:1)N-hydroxybenzylamine hydrochlorideN-benzylhydroxylamine;hydrochloride

이름 더 보기

Benzyl(hydroxy)ammonium chlorideN-Benzylhydroxylammonium chlorideN-Benzylhydroxylamine Hydrochloride >N-Benzylhydroxylamine hydrochloride 97%BenzeneMethanaMine,N-hydroxy-,hydrochloriN-hydroxy-BenzeneMethanaMine hydrochlorideN-Benzylhydroxylamine hydrochloride≥ 98%(HPLC)

N-benzyl-hydroxylamine hydrochlorideN-benzylhydroxylamine;hydron;chlorideN-Benzylhydroxylamine (hydrochloride)SB36439N-Benzylhydroxylamine hydrochloride, 95%N-Benzylhydroxyamine hydrochlorideBCP07876N-Hydroxybenzenemethanamine Hydrochloride (1:1); Benzylhydroxylamine Hydrochloride; N-Benzyl-N-hydroxyamine Hydrochloride; N-Benzylhydroxylamine Hydrochloride;

데이터베이스 식별자

CAS: 29601-98-7
PubChem CID: 11332622
DTXSID: DTXSID30462571
EC Number: 629-276-6

물성

구조 계산 물성

극성 표면적: 32.3 Å²
수소 결합 공여자 수: 3
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 10
형식 전하: 0
복잡도: 69.3

물리화학적 성질

녹는점: 108 · 108-110 °C(lit.)
저장 조건: Inert atmosphere,Room Temperature
용해도: DMSO(약간), 에틸아세테이트(약간, 가열), 메탄올(약간)에 용해됨
물리적 상태: powder to crystal
색상: 흰색에서 밝은 노란색
BRN: 507948 · 507948
InChI: InChI=1S/C7H9NO.ClH/c9-8-6-7-4-2-1-3-5-7;/h1-5,8-9H,6H2;1H
InChIKey: YSNXOQGDHGUKCZ-UHFFFAOYSA-N
SMILES: N(CC1=CC=CC=C1)O.[H]Cl

화학적 성질

White crystalline

안전 및 규제

GHS 분류

GHS Classification · 4건

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 44 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationBenzenemethanamine, N-hydroxy-, hydrochloride: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk: 3
HS 번호: 29280000
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-37/39
F 고인화성물질: 3-10
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야

용도N-Benzylhydroxylamine hydrochloride may be used in the preparation of a precursor to hitherto unknown aminocyclopentitol derivative, hydroxy functionalised 4-exo-ethoxycarbonyl-3-oxa-2-azabicyclo[3.3.0]octane system.

일반 설명N-Benzylhydroxylamine hydrochloride is a N-substituted-hydroxylamine. It participates in the ring opening of (2S,3R)-1,2-epoxy-4-penten-3-ol. Two-step synthesis of N-benzylhydroxylamine starting from dibenzylamine is reported.