6-브로모-1,1,4,4-테트라메틸-1,2,3,4-테트라히드로나프탈렌

6-Bromo-1,1,4,4-tetramethyl-1,2,3,4-tetrahydronaphthalene

HCID 226685CAS 27452-17-1

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CC1(C)CCC(C)(C)c2cc(Br)ccc21
InChIKey: NLOOVMVNNNYLFS-UHFFFAOYSA-N
분자식: C14H19Br
평균 분자량: 267.2 g/mol
단동위원소 질량: 266.06701271

이름 및 식별자

우선 이름: 6-Bromo-1,1,4,4-tetramethyl-1,2,3,4-tetrahydronaphthalene
IUPAC: 6-bromo-1,1,4,4-tetramethyl-2,3-dihydronaphthalene
현지명: 6-브로모-1,1,4,4-테트라메틸-1,2,3,4-테트라히드로나프탈렌
영어명: 6-BROMO-1,1,4,4-TETRAMETHYL-1,2,3,4-TETRAHYDRONAPHTHALENE
분자식: C14H19Br
분자량: 267.2

이름 및 동의어

6-bromo-1,1,4,4-tetramethyl-1,2,3,4-tetrahydronaphthalene27452-17-1DTXSID60280543RefChem:1073827DTXCID202316976-bromo-1,1,4,4-tetramethyl-2,3-dihydronaphthaleneC14H19BrMFCD05664407Naphthalene, 6-bromo-1,2,3,4-tetrahydro-1,1,4,4-tetramethyl-2-bromo-5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalene6-bromo-1,1,4,4-tetramethyl-1,2,3,4-tetrahydro-naphthalene2-bromo-5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaph-thalene

이름 더 보기

6-브로모-1,1,4,4-테트라메틸-1,2,3,4-테트라히드로나프탈렌4-TETRAMETHYL-14-TETRAHYDRONAPHTHALENE6-Bromo-1,1,4,4-tetramethyl-1,6-Bromo-1,1,4,4-tetramethyltetralin6-Bromo-1,1,4,4-tetramethyl-1,2,3,4-tetrahydronaphene6-BROMO-1,1,4,4-TETRAMETHYL-1,2,3,4-TETRAHYDROPHTHALENE6-Bromo-1,2,3,4-tetrahydro-1,1,4,4,-tertramethylnaphthalene56-Bromo-1,1,4,4-tetramethyl-1,2,3,4-tetrahydro-naphthalene

6-bromo-1,2,3,4-tetrahydro-1,1,4,4-tetramethylnaphthaleneNSC173966-bromo-1,1,4,4-tetramethyl-tetralinSCHEMBL1140723SCHEMBL5050763SCHEMBL29945228NLOOVMVNNNYLFS-UHFFFAOYSA-NNSC-17396

데이터베이스 식별자

CAS: 27452-17-1
PubChem CID: 226685
DTXSID: DTXSID60280543
EC Number: 190-795-1
Nikkaji: J1.147.408J

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: 15
형식 전하: 0
복잡도: 242

물리화학적 성질

녹는점: 34 °C · 34 °C
끓는 점: 110 · 110-115°C
밀도: 1.165 · 1.165±0.06 g/cm3(Predicted)
저장 조건: Sealed in dry,Room Temperature
수용성: 물에 불용성
InChI: InChI=1S/C14H19Br/c1-13(2)7-8-14(3,4)12-9-10(15)5-6-11(12)13/h5-6,9H,7-8H2,1-4H3
InChIKey: NLOOVMVNNNYLFS-UHFFFAOYSA-N
SMILES: C1(C)(C)C2=C(C=C(Br)C=C2)C(C)(C)CC1

안전 및 규제

안전 데이터

HS 번호: 2902900000
risk_code: 20/21/22-36/37/38
hazard_code: Xn
safety_code: 23-26-36/37/39
위험 참고 사항: Harmful

화학 및 산업

응용 분야

용도6-Bromo-1,1,4,4-tetramethyl-1,2,3,4-tetrahydronaphthalene is used in Synthesis and evaluation of synthetic retinoid derivatives as inducers of stem cell differentiation.