N-Allylcyclohexylamine

HCID 81115CAS 6628-00-8

기본 정보

표준 SMILES: C=CCNC1CCCCC1
InChIKey: SQGBZKZDUMBTIJ-UHFFFAOYSA-N
분자식: C9H17N
평균 분자량: 139.24 g/mol
단동위원소 질량: 139.13609954

이름 및 식별자

우선 이름: N-Allylcyclohexylamine
IUPAC: N-prop-2-enylcyclohexanamine
영어명: Allylcyclohexylamine
분자식: C9H17N
분자량: 139.24

이름 및 동의어

6628-00-8N-AllylcyclohexylamineJZS5Q23KLFEINECS 229-603-9NSC-60272DTXSID90216476NSC 60272RefChem:828959DTXCID90138967229-603-9Allylcyclohexylaminen-allylcyclohexanamine

이름 더 보기

TIMTEC-BB SBB004174CyclohexylallylamineAllylcyclohexylamine 98%Allylcyclohexylamine,98%N-(2-Propenyl)cyclohexylamine

N-prop-2-enylcyclohexanamineN-(prop-2-en-1-yl)cyclohexanamineMFCD00003836Cyclohexanamine, N-2-propenyl-cyclohexylprop-2-enylamineN-Allyl-N-cyclohexylamineNSC60272allyl-cyclohexylamine

데이터베이스 식별자

CAS: 6628-00-8
PubChem CID: 81115
DTXSID: DTXSID90216476
UNII: JZS5Q23KLF
EC Number: 229-603-9
Nikkaji: J81.248J

물성

구조 계산 물성

XLogP: 2.3
극성 표면적: 12 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 3
무거운 원자 수: 10
형식 전하: 0
복잡도: 92.9

물리화학적 성질

끓는 점: 65 · 65-66 °C/12 mmHg (lit.)
밀도: 0.962 g/mL · 0.962 g/mL at 25 °C (lit.)
굴절률: 20 · n20/D 1.4664(lit.)
인화점: 128 °F · 128 °F
저장 조건: Flammables area
산도 계수 (pKa): 10.18 · 10.18±0.20(Predicted)
물리적 상태: liquid
Specific Gravity: 0.962 · 0.962
InChI: 1S/C9H17N/c1-2-8-10-9-6-4-3-5-7-9/h2,9-10H,1,3-8H2
InChIKey: SQGBZKZDUMBTIJ-UHFFFAOYSA-N
SMILES: C=CCNC1CCCCC1

화학적 성질

clear colourless liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, 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. Each notification may be associated with multiple companies.