2,2,6-트리메틸시클로헥산카르브알데히드

Cyclohexanecarboxaldehyde, 2,2,6-trimethyl-

HCID 103695CAS 13155-57-2

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CC1CCCC(C)(C)C1C=O
InChIKey: MPLGIGIOVUTMJA-UHFFFAOYSA-N
분자식: C10H18O
평균 분자량: 154.25 g/mol
단동위원소 질량: 154.13576519

이름 및 식별자

우선 이름: Cyclohexanecarboxaldehyde, 2,2,6-trimethyl-
IUPAC: 2,2,6-trimethylcyclohexane-1-carbaldehyde
현지명: 2,2,6-트리메틸시클로헥산카르브알데히드
영어명: 2,2,6-trimethylcyclohexanecarbaldehyde
분자식: C10H18O
분자량: 154.25

이름 및 동의어

Cyclohexanecarboxaldehyde, 2,2,6-trimethyl-13155-57-2EINECS 236-094-72,2,6-TrimethylcyclohexanecarboxaldehydeDTXSID60866285RefChem:129560DTXCID208145852,2,6-Trimethylcyclohexanecarbaldehyde2,2,6-trimethylcyclohexane-1-carbaldehydeCyclohexene-1-acetaldehyde, 2,6,6-trimethylSCHEMBL1276250SCHEMBL10662475

이름 더 보기

2,2,6-트리메틸시클로헥산카르브알데히드2,6,6-Trimethylcyclohexanecarbaldehyde(1R,6S)-2,2,6-trimethylcyclohexyl carbaldehyde

1-formyl-2,6,6-trimethylcyclohexaneAKOS0159066612,2,6-trimethyl-cyclohexane-1-carbaldehydeNS00051608

데이터베이스 식별자

CAS: 13155-57-2
PubChem CID: 103695
DTXSID: DTXSID60866285
EC Number: 236-094-7
Nikkaji: J317.839K

물성

구조 계산 물성

XLogP: 3.1
극성 표면적: 17.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 1
무거운 원자 수: 11
형식 전하: 0
복잡도: 149

실험 및 물리화학적 성질

Kovats Retention Index1238

물리화학적 성질

끓는 점: 58 · 58-60 °C(Press: 10 Torr)
밀도: 0.9087 g/cm3 · 0.9087 g/cm3(Temp: 24 °C)
EPA: 2 · Cyclohexanecarboxaldehyde, 2,2,6-trimethyl- (13155-57-2)

안전 및 규제

GHS 분류

GHS Classification · 3건

This chemical does not meet GHS hazard criteria for 100% (11 of 11) of all reports.

Not Classified；Reported as not meeting GHS hazard criteria by 11 of 11 companies. For more detailed information, please visit ECHA C&L website.

Aggregated GHS information provided per 11 reports by companies from 1 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 11 of 11 reports by companies.；There are 0 notifications provided by 0 of 11 reports by companies with hazard statement code(s).；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.