TRANS-2-페닐-1-사이클로프로판카르보닐염화물

trans-2-Phenyl-1-cyclopropanecarbonyl chloride

HCID 13656CAS 939-87-7

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: O=C(Cl)[C@@H]1C[C@H]1c1ccccc1
InChIKey: SODZBMGDYKEZJG-DTWKUNHWSA-N
분자식: C10H9ClO
평균 분자량: 180.63 g/mol
단동위원소 질량: 180.0341926

이름 및 식별자

우선 이름: trans-2-Phenyl-1-cyclopropanecarbonyl chloride
IUPAC: trans-(1R,2R)-2-phenylcyclopropane-1-carbonyl chloride
현지명: TRANS-2-페닐-1-사이클로프로판카르보닐염화물
영어명: TRANS-2-PHENYL-1-CYCLOPROPANECARBONYL CHLORIDE
분자식: C10H9ClO
분자량: 180.63

이름 및 동의어

939-87-7trans-2-Phenylcyclopropanecarbonyl chloridetrans-2-Phenyl-1-cyclopropanecarbonyl chlorideDTXSID001246007RefChem:898769DTXCID401676858213-365-8(1R,2R)-2-phenylcyclopropane-1-carbonyl chloridetrans-2-Phenylcyclopropane-1-carboxylic acid chlorideCYCLOPROPANECARBONYL CHLORIDE, 2-PHENYL-, (E)-(1R,2R)-2-phenylcyclopropanecarbonyl chlorideMFCD00001278

이름 더 보기

TRANS-2-페닐-1-사이클로프로판카르보닐염화물(e)-cyclopropanecarbonylchloridTRANS-2-PHENYL-1-CYCLOPROPANECARBONY2-Phenylcyclopropanecarbonyl chloride(1S,2R)-2-phenylcyclopropanecarbonyl chloride(1R,2R)-2-phenyl-1-cyclopropanecarbonyl chloride

37107-48-5Cyclopropanecarbonyl chloride, 2-phenyl-, trans-EINECS 213-365-8NSC 806672-Phenylcyclopropanecarbonyl chloride #2-Phenylcyclopropanecarbonyl chloride, trans-Cyclopropanecarbonyl chloride, 2-phenyl-, (1R,2R)-rel-SCHEMBL452300

데이터베이스 식별자

CAS: 939-87-7
PubChem CID: 13656
DTXSID: DTXSID001246007
EC Number: 213-365-8
Nikkaji: J232.202A

물성

구조 계산 물성

XLogP: 2.6
극성 표면적: 17.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 2
무거운 원자 수: 12
형식 전하: 0
복잡도: 184

물리화학적 성질

끓는 점: 108 · 108-110 °C2 mm Hg(lit.)
밀도: 1.163 g/mL · 1.163 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.556(lit.)
인화점: 230 °F · >230 °F
물리적 상태: liquid
InChI: 1S/C10H9ClO/c11-10(12)9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6H2/t8-,9+/m0/s1
InChIKey: SODZBMGDYKEZJG-DTWKUNHWSA-N
SMILES: ClC(=O)[C@@H]1C[C@H]1c2ccccc2