기본 정보
- CAS
6560-46-9- 표준 SMILES
Cc1ncc(C=O)c(CO)c1O- InChIKey
GNKXHPULSPWUAK-UHFFFAOYSA-N- 분자식
- C8H9NO3
- 평균 분자량
- 167.16 g/mol
- 단동위원소 질량
- 167.05824315
이름 및 식별자
- 우선 이름
- Isopyridoxal
- IUPAC
- 5-hydroxy-4-(hydroxymethyl)-6-methylpyridine-3-carbaldehyde
- 현지명
- 5-하이드록시-4-(하이드록시메틸)-6-메틸-피리딘-3-카브알데하이드
- 영어명
- 5-hydroxy-4-(hydroxymethyl)-6-methyl-pyridine-3-carbaldehyde
- 분자식
- C8H9NO3
- 분자량
- 167.16
이름 및 동의어
Isopyridoxal5-hydroxy-4-(hydroxymethyl)-6-methylpyridine-3-carbaldehyde6560-46-9CHEBI:178893-Pyridinecarboxaldehyde, 5-hydroxy-4-(hydroxymethyl)-6-methyl-Nicotinaldehyde, 5-hydroxy-4-(hydroxymethyl)-6-methyl-DTXSID903315375-hydroxy-4-(hydroxymethyl)-6-methyl-3-Pyridinecarboxaldehyde5-hydroxy-4-(hydroxymethyl)-6-methyl-NicotinaldehydeRefChem:149884DTXCID90282631GNKXHPULSPWUAK-UHFFFAOYSA-N
이름 더 보기
5-하이드록시-4-(하이드록시메틸)-6-메틸-피리딘-3-카브알데하이드Pyridoxine Impurity 1255-Hydroxy-4-(hydroxymethyl)-6-methylnicotinaldehyde5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinecarbaldehyde5-hydroxy-4-(hydroxymethyl)-6-methyl-pyridine-3-carbaldehyde
C06051Vitamin B6 Impurity 85W8LVE6DT9JSCHEMBL10803937AKOS006310842DA-373092-methyl-3-hydroxy-4-hydroxymethyl-5-formylpyridine5-formyl-3-hydroxy-4-hydroxymethyl-2-methylpyridine
데이터베이스 식별자
- CAS
6560-46-9- PubChem CID
- 440899
- DTXSID
DTXSID90331537- ChEBI
CHEBI:17889- UNII
- W8LVE6DT9J
- Nikkaji
- J100.295C
물성
구조 계산 물성
- XLogP
- 0
- 극성 표면적
- 70.4 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 162
실험 및 물리화학적 성질
Physical DescriptionSolid
물리화학적 성질
- 산도 계수 (pKa)
- 4 · pKa 4.00(H2O,t =25,I>0.1) (Uncertain)
화학 및 산업
공급사5 곳
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
杭州云易国科生物科技有限公司18457506494 · [email protected]
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