Methyl beta-D-ribofuranoside

Methyl β-D-Ribofuranoside · (2R,3S,4R,5R)-2-(hydroxymethyl)-5-methoxytetrahydrofuran-3,4-diol · NSC 400285 · Methyl β-Xylobioside · -Amino-β-Resorcylate · 1-ME-D-Ribose · 1-OME-BETA-D-RIB · -D-Altropyranoside

https://huagongshe.com/ko/chemical/81983

식별자 및 물리적 특성

CAS No.	7473-45-2
분자식	C6H12O5
평균 분자량	164.16 g/mol
단동위원소 질량	164.06847348 g/mol
SMILES	CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
InChIKey	NALRCAPFICWVAQ-KVTDHHQDSA-N
PubChem CID	81983
EC No.	231-271-5
DTXSID	DTXSID301312174

화학 및 물리적 성질

XLogP	-1.6
극성 표면적	79.2
수소 결합 공여자 수	3
수소 결합 수용자 수	5
회전 가능 결합 수	2
무거운 원자 수	11
형식 전하	0
복잡도	128
녹는점	78 °C
끓는 점	348.7±42.0 °C(Predicted)
밀도	1.40±0.1 g/cm3(Predicted)
굴절률	-51 ° (C=2, H2O)
저장 조건	Sealed in dry,2-8°C
용해도	메탄올(약간 용해됨), 물(약간 용해됨, 초음파 처리)
pKa(산도 계수)	13.14±0.70(Predicted)
물리적 상태	가루
색상	흰색에서 황백색까지
용해도	물에 용해됨
InChI	InChI=1/C6H12O5/c1-10-6-5(9)4(8)3(2-7)11-6/h3-9H,2H2,1H3/t3-,4-,5-,6-/s3
InChIKey	NALRCAPFICWVAQ-QNEKUJPYNA-N
SMILES	[C@H]1(CO)O[C@@H](OC)[C@H](O)[C@@H]1O \|&1:0,4,7,9,r\|

화학적 성질

White Solid

안전 및 규제

GHS 분류	WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract 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 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.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.
규제 정보	.beta.-D-Ribofuranoside, methyl: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and Categories	Skin Irrit. 2 (100%)Eye Irrit. 2A (100%)STOT SE 3 (100%)
수질 위해 등급(WGK)	3
관세 코드	29329990
안전 문구(S)	24/25

용도

D-Ribose was converted into methyl 5-O-benzyl-beta-D-ribofuranoside and this, on tin-mediated allylation, gave a mixture of the 2-O-allyl and 3-O-allyl derivatives which were separated by chromatography.