CAS 722536-73-4 3-Bromo-1,2-dihydro-7-(phenylmethoxy)naphthalene (HCID 23087420)

기본 정보

CAS: 722536-73-4
표준 SMILES: BrC1=Cc2ccc(OCc3ccccc3)cc2CC1
InChIKey: YOQXQWKWEAXKTR-UHFFFAOYSA-N
분자식: C17H15BrO
평균 분자량: 315.2 g/mol
단동위원소 질량: 314.0306272

이름 및 식별자

우선 이름: 3-Bromo-1,2-dihydro-7-(phenylmethoxy)naphthalene
IUPAC: 3-bromo-7-phenylmethoxy-1,2-dihydronaphthalene
현지명: 7-(벤질옥시)-3-broMo-1,2-디히드로나프탈렌
영어명: 7-(benzyloxy)-3-broMo-1,2-dihydronaphthalene
분자식: C17H15BrO
분자량: 315.2

이름 및 동의어

722536-73-47-(Benzyloxy)-3-bromo-1,2-dihydronaphthalene3-bromo-1,2-dihydro-7-(phenylmethoxy)NaphthaleneDTXSID901238435RefChem:498132DTXCID001669354890-815-57-benzyloxy-3-bromo-1,2-dihydronaphthalene7-Benzyloxy-3-bromo-1,2(2H)-naphthaleneSCHEMBL225661SCHEMBL30616511WLZ5240

이름 더 보기

7-(벤질옥시)-3-broMo-1,2-디히드로나프탈렌3-bromo-7-phenylmethoxy-1,2-dihydronaphthaleneNaphthalene, 3-bromo-1,2-dihydro-7-(phenylmethoxy)-

YOQXQWKWEAXKTR-UHFFFAOYSA-NMFCD20040372AS-95580FB165481DB-0745377-(benzyloxy)-3-broMo-1,2-dihydronaphthalen7-(Benzyloxy)-3-bromo-1,2-dihydroxanthalene7-Benzyloxy-3-bromo-1,2-dihydro-naphthalene

데이터베이스 식별자

CAS: 722536-73-4
PubChem CID: 23087420
DTXSID: DTXSID901238435
EC Number: 890-815-5

물성

구조 계산 물성

XLogP: 4.9
극성 표면적: 9.2 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 3
무거운 원자 수: 19
형식 전하: 0
복잡도: 319

물리화학적 성질

InChI: InChI=1S/C17H15BrO/c18-16-8-6-15-11-17(9-7-14(15)10-16)19-12-13-4-2-1-3-5-13/h1-5,7,9-11H,6,8,12H2
InChIKey: YOQXQWKWEAXKTR-UHFFFAOYSA-N
SMILES: C1C2=C(C=CC(OCC3=CC=CC=C3)=C2)C=C(Br)C1