기본 정보
- CAS
3415-68-7- 표준 SMILES
O=S(=O)(O)Oc1ccc(C(O)CO)cc1O- InChIKey
MFYFKAXYRXODPL-UHFFFAOYSA-N- 분자식
- C8H10O7S
- 평균 분자량
- 250.23 g/mol
- 단동위원소 질량
- 250.01472383
개요
3,4-Dihydroxyphenylglycol O-sulfate is an aryl sulfate.
이름 및 식별자
- 우선 이름
- 3,4-Dihydroxyphenylglycol O-sulfate
- IUPAC
- [4-(1,2-dihydroxyethyl)-2-hydroxyphenyl] hydrogen sulfate
이름 및 동의어
3,4-Dihydroxyphenylglycol O-sulfate3,4-Dihydroxyphenylglycol O-sulphate3,4-Dihydroxyphenylethylene glycol sulfate3,4-Dihydroxyphenylethylene glycol sulphate[4-(1,2-dihydroxyethyl)-2-hydroxyphenyl]oxidanesulfonic acid(4-(1,2-Dihydroxyethyl)-2-hydroxyphenyl)oxidanesulfonate(4-(1,2-Dihydroxyethyl)-2-hydroxyphenyl)oxidanesulphonate[4-(1,2-Dihydroxyethyl)-2-hydroxyphenyl]oxidanesulfonate[4-(1,2-Dihydroxyethyl)-2-hydroxyphenyl]oxidanesulphonate(4-(1,2-dihydroxyethyl)-2-hydroxyphenyl)oxidanesulfonic acid(4-(1,2-Dihydroxyethyl)-2-hydroxyphenyl)oxidanesulphonic acid[4-(1,2-Dihydroxyethyl)-2-hydroxyphenyl]oxidanesulphonic acid
이름 더 보기
RefChem:911573,4-Dihydroxyphenylglycol O-sulfuric acid3,4-Dihydroxyphenylglycol O-sulphuric acid3415-68-7CHEBI:166465[4-(1,2-dihydroxyethyl)-2-hydroxyphenyl] hydrogen sulate
데이터베이스 식별자
- CAS
3415-68-7- PubChem CID
- 22833570
물성
구조 계산 물성
- XLogP
- -1.6
- 극성 표면적
- 133 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 16
- 형식 전하
- 0
- 복잡도
- 309
실험 및 물리화학적 성질
Physical DescriptionSolid
관련 반응
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