4-(Methylsulphonyl)phenylhydrazine

HCID 70142CAS 17852-67-4

기본 정보

표준 SMILES: CS(=O)(=O)c1ccc(NN)cc1
InChIKey: ZHYAENSFCNMJQQ-UHFFFAOYSA-N
분자식: C7H10N2O2S
평균 분자량: 186.23 g/mol
단동위원소 질량: 186.04629856

이름 및 식별자

우선 이름: 4-(Methylsulphonyl)phenylhydrazine
IUPAC: (4-methylsulfonylphenyl)hydrazine
영어명: [4-(Methylsulfonyl)phenyl]hydrazine hydrochloride
분자식: C7H10N2O2S
분자량: 186.23

이름 및 동의어

877-66-74-(Methylsulphonyl)phenylhydrazineEINECS 212-895-7p-(Methylsulfonyl)phenylhydrazineRefChem:516393212-895-7(4-(Methylsulfonyl)phenyl)hydrazine4-(METHYLSULFONYL)PHENYLHYDRAZINE(4-methylsulfonylphenyl)hydrazine(4-methanesulfonylphenyl)hydrazineHydrazine, [4-(methylsulfonyl)phenyl]-[4-(methylsulfonyl)phenyl]hydrazine

이름 더 보기

TIMTEC-BB SBB003335(4-mesylphenyl)hydrazine4-METHYLSULPHONYLPHENYLHYDRAZINE4-MethylsulfonylphenylhydrazineHCl[p-(Methylsulfonyl)phenyl]hydrazine1-[4-(Methylsulfonyl)phenyl]hydrazine4-METHYLSULPHONYLPHENYLHYDRAZINE HYDROCHLORIDE4-(METHYLSULFONYL)PHENYLHYDRAZINE HYDROCHLORIDE

MFCD000075804-Methylsulfonylphenylhydrazine(4-methanesulfonyl-phenyl)-hydrazineAS-49508EN300-36377Z316087984GERANICACIDCelogen TSH-C

데이터베이스 식별자

CAS: 17852-67-4、877-66-7
PubChem CID: 70142
DTXSID: DTXSID30939096
EC Number: 212-895-7
Nikkaji: J124.085D

물성

구조 계산 물성

XLogP: -0.3
극성 표면적: 80.6 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 4
회전 가능 결합 수: 2
무거운 원자 수: 12
형식 전하: 0
복잡도: 224

물리화학적 성질

녹는점: 202 °C · 202 °C
끓는 점: 418.7 · 418.7±37.0 °C(Predicted)
밀도: 1.351 · 1.351±0.06 g/cm3(Predicted)
저장 조건: -20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
산도 계수 (pKa): 3.97 · 3.97±0.20(Predicted)
InChI: InChI=1S/C7H10N2O2S/c1-12(10,11)7-4-2-6(9-8)3-5-7/h2-5,9H,8H2,1H3
InChIKey: ZHYAENSFCNMJQQ-UHFFFAOYSA-N
SMILES: N(C1=CC=C(S(C)(=O)=O)C=C1)N