기본 정보
- 표준 SMILES
OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O- InChIKey
WQZGKKKJIJFFOK-DVKNGEFBSA-N- 분자식
- C6H12O6
- 평균 분자량
- 180.16 g/mol
- 단동위원소 질량
- 180.0633881
이름 및 식별자
- 우선 이름
- Alpha-D-Glucose
- IUPAC
- (2S,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol
- 현지명
- 알파-D-글루코피라노스
- 영어명
- Dextrose
- 분자식
- C6H12O6
- 분자량
- 180.16
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
492-62-6- PubChem CID
- 79025
- DTXSID
DTXSID30197710- ChEMBL
CHEMBL423707- ChEBI
CHEBI:28102- UNII
- 5J5I9EB41E
- EC Number
- 207-757-8
- Nikkaji
- J44.217H
물성
구조 계산 물성
- XLogP
- -2.6
- 극성 표면적
- 110 Ų
- 수소 결합 공여자 수
- 5
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 151
실험 및 물리화학적 성질
Physical Description
White crystalline powder; Odorless; [Acros Organics MSDS]
Solid
Collision Cross Section
146.2 Ų [M+Na]+ [CCS Type: DT; Method: single field calibrated with Agilent tune mix (Agilent)]
146.6 Ų [M+Na]+ [CCS Type: DT; Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]
146.5 Ų [M+Na]+;147.1 Ų [M+Na]+
물리화학적 성질
- 녹는점
- 153 · 153-156 °C(lit.)
- 끓는 점
- 232.96 °C · 232.96°C (rough estimate)
- 밀도
- 1.544 g/cm3 · 1.544g/cm3
- 굴절률
- 20 · n20/D 1.362
- 저장 조건
- Sealed in dry,Room Temperature
- 용해도
- 2 O: · H2O: 1 M at 20 °C, 투명, 무색
- 물리적 상태
- 액체
- 산도 계수 (pKa)
- 12.12 · 12.12±0.70(Predicted)
- 색상
- 하얀색
- 수소이온지수(pH)
- 5 · 5.0-8.0 (25℃)
- 냄새
- 냄새 없는
- 수용성
- 450.5 g/L · 450.5g/L(25℃)
- BRN
- 1281608 · 1281608
- InChI
- 1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1
- InChIKey
- WQZGKKKJIJFFOK-DVKNGEFBSA-N
- SMILES
- OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O
- LogP
- -1.88 · -1.880 (est)
- CAS Number Unlabeled
- 50 · 50-99-7
화학적 성질
white, odorless, fine crystalline powder
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 98% (48 of 49) of all reports.
Not Classified;Reported as not meeting GHS hazard criteria by 48 of 49 companies (only 2% companies provided GHS information). For more detailed information, please visit ECHA C&L website.
Aggregated GHS information provided per 49 reports by companies from 3 notifications to the ECHA C&L Inventory.;Reported as not meeting GHS hazard criteria per 48 of 49 reports by companies.;There is 1 notification provided by 1 of 49 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
유해성 정보
Regulatory Information
Chemical: .alpha.-D-Glucopyranose
.alpha.-D-Glucopyranose: Does not have an individual approval but may be used under an appropriate group standard
규제 정보
Regulatory Information
Chemical: .alpha.-D-Glucopyranose
.alpha.-D-Glucopyranose: Does not have an individual approval but may be used under an appropriate group standard
안전 데이터
- wgk
- 3
- rtecs
- LZ6600000
- HS 번호
- 17023000
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36/37/39
- F 고인화성물질
- 3
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
약리 정보
Metabolite Pathways
Fanconi-bickel syndrome;Fructose and mannose metabolism;Fructose intolerance, hereditary;Fructose-1,6-diphosphatase deficiency;Fructosuria;Galactose Metabolism;Galactosemia;Galactosemia II (GALK);Galactosemia III;Glycogen Storage Disease Type 1A (GSD1A) or Von Gierke Disease;Total 28 pathways, visit the HMDB page for details
용도 및 제조
응용 분야
용도α-D-Glucose is used:As a reducing agent in the preparation superparamagnetic ferrous oxide (Fe3O4) nanoparticles and silver nanocrystals.As an additive for the formation of isoporous polystyrene-block-poly(4-vinylpyridine) (PS-b-P4VP) diblock copolymer membranes.For glycosylation of cell-penetrating poly(disulfide)s (CPDs) with improved solubility to achieve multifunctional cellular uptake.As a precursor in the synthesis of metal/carbon nanohybrids under hydrothermal conditions.
상·하류 제품 정보
상류 원료
하류 제품
공급사50 곳
추가 설명
정의ChEBI: D-Glucopyranose having alpha-configuration at the anomeric centre.
관련 반응
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