1-(2-프탈리미도부타노일)염화물

4-(1,3-Dioxoisoindolin-2-yl)butanoyl chloride

HCID 594886CAS 10314-06-4

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: O=C(Cl)CCCN1C(=O)c2ccccc2C1=O
InChIKey: STXHPGKNMJVJKL-UHFFFAOYSA-N
분자식: C12H10ClNO3
평균 분자량: 251.66 g/mol
단동위원소 질량: 251.0349209

이름 및 식별자

우선 이름: 4-(1,3-Dioxoisoindolin-2-yl)butanoyl chloride
IUPAC: 4-(1,3-dioxoisoindol-2-yl)butanoyl chloride
현지명: 1-(2-프탈리미도부타노일)염화물
영어명: 1-(2-PhthaliMidobutanoyl)chloride
분자식: C12H10ClNO3
분자량: 251.67

이름 및 동의어

10314-06-41-(2-Phthalimidobutyryl)chloride4-(1,3-dioxoisoindolin-2-yl)butanoyl chlorideN-(4-Chloro-4-oxobutyl)phthalimide4-(1,3-dioxoisoindol-2-yl)butanoyl chloride1-(2-PhthaliMidobutanoyl)chlorideMFCD02656536N,N-Phthaloyl-GABA chloride4-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl chloride4-phthalimidobutyryl chlorideSCHEMBL922425gamma-phthalimidobutyryl chloride

이름 더 보기

1-(2-프탈리미도부타노일)염화물1-(2-Phthalimidobutyryl)chloride - [P1003]1,3-Dihydro-1,3-dioxo-2H-isoindol-2-butanoyl chloride1,3-Dihydro-1,3-dioxo-2H-isoindole-2-butanoyl chloride2H-Isoindole-2-butanoyl chloride, 1,3-dihydro-1,3-dioxo-

DTXSID003441784-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)butanoyl chlorideSBB001831AKOS015946050AT29531SB64111DA-16125NS-03754

데이터베이스 식별자

CAS: 10314-06-4
PubChem CID: 594886
DTXSID: DTXSID00344178
EC Number: 808-915-4
Nikkaji: J2.569.709J

물성

구조 계산 물성

XLogP: 2.3
극성 표면적: 54.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 4
무거운 원자 수: 17
형식 전하: 0
복잡도: 332

물리화학적 성질

물리적 상태: solid
InChI: 1S/C12H10ClNO3/c13-10(15)6-3-7-14-11(16)8-4-1-2-5-9(8)12(14)17/h1-2,4-5H,3,6-7H2
InChIKey: STXHPGKNMJVJKL-UHFFFAOYSA-N
SMILES: ClC(=O)CCCN1C(=O)c2c(cccc2)C1=O