CAS 2617-98-3 5,6,7,8-Tetrahydro-2-methylquinoline (HCID 12229420)

기본 정보

CAS: 2617-98-3
표준 SMILES: Cc1ccc2c(n1)CCCC2
InChIKey: AUSMPOZTRKHFPG-UHFFFAOYSA-N
분자식: C10H13N
평균 분자량: 147.22 g/mol
단동위원소 질량: 147.10479942

이름 및 식별자

우선 이름: 5,6,7,8-Tetrahydro-2-methylquinoline
IUPAC: 2-methyl-5,6,7,8-tetrahydroquinoline
영어명: 5,6,7,8-Tetrahydroquinaldine
분자식: C10H13N
분자량: 147.22

이름 및 동의어

5,6,7,8-Tetrahydro-2-methylquinolineRefChem:527867678-622-22617-98-32-methyl-5,6,7,8-tetrahydroquinoline5,6,7,8-TetrahydroquinaldineMFCD00191581Quinoline, 5,6,7,8-tetrahydro-2-methyl-2-methyl-5,6,7,8-tetrahydro-quinolineQuinoline, 5,6,7,8-tetrahydromethyl-orb3023506SCHEMBL2182053

이름 더 보기

tetra-quinaldin5,6,7,8-tetra-quinaL5,6,7,8-tetra-quinaldine5.6.7.8-tetra-2-methylquinoline5,6,7,8-TETRAHYDROQUINALDINE 97+%5,6,7,8-Tetrahydroquinaldine ISO 9001：2015 REACH

SCHEMBL4056257SCHEMBL45991165.6.7.8-Tetrahydro-chinaldinSCHEMBL31494678DTXSID30481449TN9512AKOS015891506AC-19075

데이터베이스 식별자

CAS: 2617-98-3
PubChem CID: 12229420
DTXSID: DTXSID30481449
EC Number: 678-622-2
Nikkaji: J534.176K

물성

구조 계산 물성

XLogP: 2.5
극성 표면적: 12.9 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 0
무거운 원자 수: 11
형식 전하: 0
복잡도: 133

물리화학적 성질

끓는 점: 225 °C · 225 °C
밀도: 1 · 1.00
굴절률: 1.534 to · 1.5340 to 1.5380
저장 조건: Sealed in dry,Room Temperature
물리적 상태: 투명한 액체
산도 계수 (pKa): 7.02 · 7.02±0.20(Predicted)
색상: Colorless to Light yellow to Light orange

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.