Diallylcarbamyl chloride

HCID 3449313

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 25761-72-2
표준 SMILES: C=CCN(CC=C)C(=O)Cl
InChIKey: MGQPJLWKFQNTOZ-UHFFFAOYSA-N
분자식: C7H10ClNO
평균 분자량: 159.61 g/mol
단동위원소 질량: 159.0450916

이름 및 식별자

우선 이름: Diallylcarbamyl chloride
IUPAC: N,N-bis(prop-2-enyl)carbamoyl chloride
영어명: DIALLYLCARBAMYL CHLORIDE
분자식: C7H10ClNO
분자량: 159.61

이름 및 동의어

Diallylcarbamyl chloride25761-72-2DTXSID60392574RefChem:586180DTXCID10343435624-311-1diallylcarbamic chlorideN,N-bis(prop-2-enyl)carbamoyl chlorideN,N-BIS(PROP-2-EN-1-YL)CARBAMOYL CHLORIDEMFCD02093718n,n-diallylcarbamoyl chloridediallylcarbamicchloride

이름 더 보기

Diallylcarbamyl chloride 97%Carbamic chloride, N,N-di-2-propen-1-yl-DIALLYLCARBAMYL CHLORIDE ISO 9001：2015 REACH

diallylcarbamoyl chlorideSCHEMBL692534Diallylcarbamyl chloride, 97%MGQPJLWKFQNTOZ-UHFFFAOYSA-NAKOS022463789Di(prop-2-en-1-yl)carbamoyl chlorideN,N-di-2-propen-1-yl-carbamic chlorideLS-13287

데이터베이스 식별자

CAS: 25761-72-2
PubChem CID: 3449313
DTXSID: DTXSID60392574
EC Number: 624-311-1
Nikkaji: J1.972.820J

물성

구조 계산 물성

XLogP: 2.1
극성 표면적: 20.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 4
무거운 원자 수: 10
형식 전하: 0
복잡도: 135

물리화학적 성질

끓는 점: 214 · 214-220 °C(lit.)
밀도: 1.069 g/mL · 1.069 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.48(lit.)
인화점: 86 °C · 86 °C
저장 조건: 2 · 2-8°C
InChI: 1S/C7H10ClNO/c1-3-5-9(6-4-2)7(8)10/h3-4H,1-2,5-6H2
InChIKey: MGQPJLWKFQNTOZ-UHFFFAOYSA-N
SMILES: ClC(=O)N(CC=C)CC=C

화학적 성질

Colorless to pale yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

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

Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory.；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.