디페닐디티오퍼옥시무수물

Bis(thiobenzoyl) Disulfide

HCID 10902862CAS 5873-93-8

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: S=C(SSC(=S)c1ccccc1)c1ccccc1
InChIKey: LWGLGSPYKZTZBM-UHFFFAOYSA-N
분자식: C14H10S4
평균 분자량: 306.5 g/mol
단동위원소 질량: 305.96653432

이름 및 식별자

우선 이름: Bis(thiobenzoyl) Disulfide
IUPAC: benzenecarbonothioylsulfanyl benzenecarbodithioate
현지명: 디페닐디티오퍼옥시무수물
영어명: Diphenyldithioperoxyanhydride
분자식: C14H10S4
분자량: 306.49

이름 및 동의어

bis(thiobenzoyl) disulfideRefChem:569292687-393-8Diphenyldithioperoxyanhydride5873-93-8Benzothioic dithioperoxyanhydrideMFCD12911774benzenecarbonothioylsulfanyl benzenecarbodithioatebis(thiobenzoyl)disulfidedi(thiobenzoyl) Disulfidethiobenzoyl disulfidedithiobenzoyl disulfide

이름 더 보기

디페닐디티오퍼옥시무수물Disulfide, bis(thiobenzoyl)Bis(phenylthiocarbonyl) DisulfideDisulfide,bis(phenylthioxomethyl)Bis(phenylthioxometh?yl) disulfideBis(thiobenzoyl) disulfide >90% (HPLC)Di(thiobenzoyl) disulfide Disulfide,bis(phenylthioxomethyl)bis(Thiobenzoyl) disulfide@1000 μg/mL in Hexane:Toluene (80:20)

Dithiobenzoyl disulphidedi(thiobenzoyl)disulfideSCHEMBL176121Bis(phenylthioxomethyl)disulfideLWGLGSPYKZTZBM-UHFFFAOYSA-NDTXSID601337694AKOS005174062Bis(thiobenzoyl) disulfide, >95% (HPLC)

데이터베이스 식별자

CAS: 5873-93-8
PubChem CID: 10902862
DTXSID: DTXSID601337694
EC Number: 687-393-8
Nikkaji: J1.031.810F

물성

구조 계산 물성

XLogP: 5
극성 표면적: 115 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 5
무거운 원자 수: 18
형식 전하: 0
복잡도: 258

물리화학적 성질

녹는점: 94 · 94-96°C
끓는 점: 446.8 · 446.8±28.0 °C(Predicted)
밀도: 1.367 · 1.367±0.06 g/cm3(Predicted)
저장 조건: -20 °C · -20°C
용해도: 클로로포름(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태: 고체
InChI: 1S/C14H10S4/c15-13(11-7-3-1-4-8-11)17-18-14(16)12-9-5-2-6-10-12/h1-10H
InChIKey: LWGLGSPYKZTZBM-UHFFFAOYSA-N
SMILES: S=C(SSC(=S)c1ccccc1)c2ccccc2

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H400 (97.5%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]

P273, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.