4-Benzyl-2-(chloromethyl)morpholine

HCID 2801562CAS 40987-25-5

기본 정보

표준 SMILES: ClCC1CN(Cc2ccccc2)CCO1
InChIKey: GVWRZZNYCOTWNN-UHFFFAOYSA-N
분자식: C12H16ClNO
평균 분자량: 225.71 g/mol

이름 및 식별자

우선 이름: 4-Benzyl-2-(chloromethyl)morpholine
IUPAC: 4-benzyl-2-(chloromethyl)morpholine

이름 및 동의어

4-benzyl-2-(chloromethyl)morpholineRefChem:518458692-342-840987-25-54-Benzyl-2-chloromethyl-morpholine2-Chloromethyl-4-benzylmorpholineMFCD02681886Morpholine, 2-(chloromethyl)-4-(phenylmethyl)-2-(chloromethyl)-4-(phenylmethyl)morpholine3-(Chloromethyl)-4-(phenylmethyl)morpholineSCHEMBL7357294-benzyl-2-chloromethylmorpholine

이름 더 보기

BUTTPARK 85\12-31GVWRZZNYCOTWNN-UHFFFAOYSA-N2-chloromethyl-4-benzyl morpholine2-chloromethyl-4-benzyl-morpholine4-benzyl-2-chloromethyl morpholine2-(chloromethyl)-4-benzylmorpholineSBB054965AKOS000122911

데이터베이스 식별자

CAS: 40987-25-5
PubChem CID: 2801562
EC Number: 692-342-8

물성

구조 계산 물성

XLogP: 2
극성 표면적: 12.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 3
무거운 원자 수: 15
형식 전하: 0
복잡도: 182

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]

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

Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.