메틸-D-글루코시드

메틸-D-글루코시드 · 알파-D-메틸글루코시드 · 97-30-3 · (2R,3S,4S,5R,6S)-2-(hydroxyMethyl)-6-Methoxytetrahydro-2H-pyran-3,4,5-triol · Methyl α-D-glucopyranoside · METHYL A-D-GLUCOPYRANOSIDE · METHYL ALPHA-D-GLUCOPYRANOSIDE · α-D-methylglucoside

https://huagongshe.com/ko/chemical/64947

식별자 및 물리적 특성

CAS No.	97-30-3
분자식	C7H14O6
평균 분자량	194.18 g/mol
단동위원소 질량	194.07903817 g/mol
SMILES	CO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIKey	HOVAGTYPODGVJG-ZFYZTMLRSA-N
PubChem CID	64947
ChEMBL	CHEMBL131853
ChEBI	CHEBI:320061
EC No.	202-571-3
DTXSID	DTXSID7026605
현지명	메틸-D-글루코시드

화학 및 물리적 성질

XLogP	-2.2
극성 표면적	99.4
수소 결합 공여자 수	4
수소 결합 수용자 수	6
회전 가능 결합 수	2
무거운 원자 수	13
형식 전하	0
복잡도	163
물질 분류	Other Classes -> Other Organic Compounds
Food Contact Substances	FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physical Description	Solid[Merck Index] White crystals[Acros Organics MSDS]
녹는점	169-171 °C(lit.)
끓는 점	200 °C (0.2 mmHg)
밀도	1,46 g/cm3
증기압	0Pa at 25℃
굴절률	157.5 ° (C=10, H2O)
저장 조건	Inert atmosphere,Room Temperature
용해도	메탄올(약간 용해됨), 물(약간 용해됨)
물리적 상태	미세 결정성 분말
pKa(산도 계수)	pKa (25°): 13.71
색상	하얀색
생물학적 소스	synthetic (organic)
용해도	108g/100mL(20℃)
Merck	14,6080
BRN	81568
InChI	1S/C7H14O6/c1-12-7-6(11)5(10)4(9)3(2-8)13-7/h3-11H,2H2,1H3/t3-,4-,5+,6-,7+/m1/s1
InChIKey	HOVAGTYPODGVJG-ZFYZTMLRSA-N
SMILES	CO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
LogP(분배 계수)	-2.35 at 25℃
NIST	«alpha»-Methyl-(d)-glucoside(97-30-3)
EPA	.alpha.-D-Glucopyranoside, methyl (97-30-3)

화학적 성질

White Powder

안전 및 규제

GHS 분류	This chemical does not meet GHS hazard criteria for 100% (464 of 464) of all reports.Not ClassifiedAggregated GHS information provided per 464 reports by companies from 1 notifications to the ECHA C&L Inventory.
규제 정보	Chemical: .alpha.-D-Glucopyranoside, methylStatus: Active Update: 27-02-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/23022.alpha.-D-Glucopyranoside, methyl: Does not have an individual approval but may be used under an appropriate group standard
기타 안전 정보	Evaluation - Chemicals that are unlikely to require further regulation to manage risks to environment
유해성 요약	May cause irritation[Acros Organics MSDS] See Glucose.
EPA Safer Chemical	Chemical: alpha-Methylglucoside
Hazard Classes and Categories	Not Classified
수질 위해 등급(WGK)	3
TSCA 등재 상태	TSCA listed
관세 코드	29321900
안전 문구(S)	24/25
기존화학 물질	KE-24118
F 고인화성물질	3-10
저장 분류	11 - Combustible Solids

용도

manufacture of reconstituted and upgraded drying oils; tall oil esters and varnishes; fatty acid esters; plasticizers; nonionic surface active agents; fast and hard drying alkyd resins, and so-called plasticizing alkyds. In making glucoside hydroxypropyl ethers for polyurethan foam production.