니트로페닐갈락토사이드
Nitrophenylgalactosides
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기본 정보
- CAS
28347-45-7- 표준 SMILES
O=[N+]([O-])c1ccccc1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O- InChIKey
KUWPCJHYPSUOFW-YBXAARCKSA-N- 분자식
- C12H15NO8
- 평균 분자량
- 301.25 g/mol
- 단동위원소 질량
- 301.07976644
개요
2-nitrophenyl beta-D-galactoside is a beta-D-galactoside having a 2-nitrophenyl substituent at the anomeric position. It has a role as a chromogenic compound. It is a beta-D-galactoside and a C-nitro compound. It is functionally related to a 2-nitrophenol.
이름 및 식별자
- 우선 이름
- Nitrophenylgalactosides
- IUPAC
- (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-(2-nitrophenoxy)oxane-3,4,5-triol
- 현지명
- 니트로페닐갈락토사이드
- 영어명
- Nitrophenylgalactosides
- 분자식
- C12H15NO8
- 분자량
- 301.2494
이름 및 동의어
NitrophenylgalactopyranosidesNITROPHENYLGALACTOSIDES28347-45-7beta-D-Galactopyranoside, nitrophenylRefChem:389153369-07-32-Nitrophenyl-beta-D-galactopyranosideONPG2-Nitrophenyl beta-D-galactopyranosideo-Nitrophenyl beta-D-galactopyranoside2-Nitrophenyl beta-D-galactoside(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-(2-nitrophenoxy)oxane-3,4,5-triol
이름 더 보기
니트로페닐갈락토사이드
2-Nitrophenyl |A-D-galactopyranosideMFCD00063255(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-(2-nitrophenoxy)tetrahydro-2H-pyran-3,4,5-triolo-Nitrophenyl-beta-D-galactosideb-D-Galactopyranoside, 2-nitrophenyl8RFX6AT9WP.beta.-D-Galactopyranoside, 2-nitrophenyl30677-14-6
데이터베이스 식별자
- CAS
28347-45-7、30677-14-6、369-07-3- PubChem CID
- 96647
- DTXSID
DTXSID10861907- ChEMBL
CHEMBL1229648- ChEBI
CHEBI:90144- UNII
- 8RFX6AT9WP
물성
구조 계산 물성보충 중
- XLogP
- -1.2
- 극성 표면적
- 145 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 21
- 형식 전하
- 0
- 복잡도
- 362
실험 및 물리화학적 성질
Chemical ClassesOther Uses -> Biochemical Research
DrugsPharmaceuticals -> Listed in ZINC15
Solubility>45.2 [ug/mL] (The mean of the results at pH 7.4)
Physical DescriptionBeige solid; [Sigma-Aldrich MSDS]
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 40% (2 of 5) of reports.
Warning
H315 (20%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 5 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: .beta.-D-Galactopyranoside, 2-nitrophenyl
.beta.-D-Galactopyranoside, 2-nitrophenyl: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazards SummaryMay cause irritation; [Sigma-Aldrich MSDS]
Hazard Classes and CategoriesSkin Irrit. 2 (20%)
관련 반응
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