1,2,3,4-테트라하이드로-1,1,2,4,4,7-헥사메틸나프탈렌

1,1,3,4,4,6-Hexamethyltetralin

HCID 102750CAS 2084-69-7

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Cc1ccc2c(c1)C(C)(C)C(C)CC2(C)C
InChIKey: JIVANURAWUCQIG-UHFFFAOYSA-N
분자식: C16H24
평균 분자량: 216.36 g/mol
단동위원소 질량: 216.18780077

이름 및 식별자

우선 이름: 1,1,3,4,4,6-Hexamethyltetralin
IUPAC: 1,1,2,4,4,7-hexamethyl-2,3-dihydronaphthalene
현지명: 1,2,3,4-테트라하이드로-1,1,2,4,4,7-헥사메틸나프탈렌
영어명: 1,2,3,4-tetrahydro-1,1,2,4,4,7-hexamethylnaphthalene
분자식: C16H24
분자량: 216.36

이름 및 동의어

1,1,3,4,4,6-hexamethyltetralinNaphthalene, 1,2,3,4-tetrahydro-1,1,2,4,4,7-hexamethyl-NXY1U0X89R1,2,3,4-Tetrahydro-1,1,2,4,4,7-hexamethylnaphthaleneEINECS 218-226-5UNII-NXY1U0X89R1,1,3,4,4,6-hexamethyl-1,2,3,4-tetrahydronaphthaleneDTXSID40883793EC 218-226-5RefChem:196645DTXCID7010232802084-69-7

이름 더 보기

1,2,3,4-테트라하이드로-1,1,2,4,4,7-헥사메틸나프탈렌HEXAMETHYLTETRALIN1,1,2,4,4,7-hexamethyl-1,2,3,4-tetrahydro-naphthalene

1,2,3,4-Tetrahydro-1,1,3,4,4,6-hexamethylnaphthaleneSCHEMBL4447680SCHEMBL4874095SCHEMBL313526431,1,2,4,4,7-Hexamethyl-1,2,3,4-tetrahydronaphthalene1,1,2,4,4,7-hexamethyltetralin1,1,3,4,4,6-hexamethyl tetralinNS00009214

데이터베이스 식별자

CAS: 2084-69-7
PubChem CID: 102750
DTXSID: DTXSID40883793
UNII: NXY1U0X89R
EC Number: 218-226-5
Nikkaji: J20.995C

물성

구조 계산 물성

XLogP: 5.7
극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 0
회전 가능 결합 수: 0
무거운 원자 수: 16
형식 전하: 0
복잡도: 261

물리화학적 성질

녹는점: 66 · 66-67 °C
끓는 점: 80 °C · 80 °C(Press: 1 Torr)
밀도: 0.867 · 0.867±0.06 g/cm3(Predicted)
증기압: 0.4 Pa · 0.4Pa at 25℃
Henry's Law Constant: 4.2 · 4.2×10-4 mol/(m3Pa) at 25℃, Zhang et al. (2010)
EPA: 1 · Naphthalene, 1,2,3,4-tetrahydro-1,1,2,4,4,7-hexamethyl- (2084-69-7)