AG00IDDG

84380-01-8 | a-D-Glucopyranoside, 4-hydroxyphenyl

AG00IDDG

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CAS Number	84380-01-8
Catalog Number	AG00IDDG(AGN-PC-0URG5F)
Chemical Name	a-D-Glucopyranoside, 4-hydroxyphenyl
IUPAC Name	(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(4-hydroxyphenoxy)oxane-3,4,5-triol
InChI	InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12+/m1/s1
InChI Key	BJRNKVDFDLYUGJ-ZIQFBCGOSA-N
MDL Number	MFCD09838262
Molecular Formula	C12H16O7
Molecular Weight	272.2512
SMILES	O[C@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)[C@H]1OC2=CC=C(O)C=C2
UNII	72VUP07IT5
Synonyms	alpha-Arbutin, 84380-01-8, 4-Hydroxyphenyl a-D-glucopyranoside, UNII-72VUP07IT5, PubChem16460, AC1L4KBI, 4-hydroxyphenyl alpha-D-glucopyranoside, 72VUP07IT5, CHEBI:29710, (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(4-hydroxyphenoxy)oxane-3,4,5-triol, (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(4-hydroxyphenoxy)tetrahydropyran-3,4,5-triol, alpha arbutin, C12H16O7, alpha-Arbutoside, a-Arbutin, AK-77730, I+/--Arbutin, 4-Hydroxyphenyl-alpha-D-glucopyranoside, alpha-D-Glucopyranoside, 4-hydroxyphenyl, SCHEMBL435261, CHEMBL226495, 4-hydroxyphenyl-D-lucopyranoside, DTXSID20233358, alpha-Arbutin, analytical standard, hydroquinone alpha-D-glucopyranoside, ZINC4102324, 4'-hydroxyphenyl alpha-D-glucoside;, a-D-Glucopyranoside, 4-hydroxyphenyl, CA-564, MFCD09838262, AKOS015905235, EBD2185055, AJ-48067, AN-35897, AS-15466, P486, SC-19894, AX8040815, ST2411470, FT-0082794, FT-0649357, C12079, M-8391, A840768, W-203913, (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(4-hydroxyphenoxy)tetrahydro-2H-pyran-3,4,5-triol, (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(4-oxidanylphenoxy)oxane-3,4,5-triol, arbutin, 4-Hydroxyphenyla-D-glucopyranoside, CID158637, ACN-035685, 497-76-7,

Complexity	279
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	5
Defined Bond Stereocenter Count	0
Exact Mass	272.09g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	5
Isotope Atom Count	0
Molecular Weight	272.253g/mol
Monoisotopic Mass	272.09g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	120A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H332-H335
Precuationary statements	P261-P280-P305+P351+P338
Siginal words

Certificate of Analysis

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