CAS: 572-09-8
Nom: [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-bromooxan-2-yl]methyl acetate
SMILES:
CC(=O)OCC1C(C(C(C(O1)Br)OC(=O)C)OC(=O)C)OC(=O)CMolecular Processing
Molecular formula
C14H19BrO9
Molecular weight
411.2
Exact mass
410.0212
XLogP
0.46
TPSA
114.43
H-bond donors
0
H-bond acceptors
9
Rotatable bonds
5
Heavy atoms
24
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
5
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
80.88
Supplementary Information
InChIKey: CYAYKKUWALRRPA-RGDJUOJXSA-N
Synonymes
alpha-D-Glucopyranosyl bromide, tetraacetate.alpha.-D-Glucopyranosyl bromide, tetraacetateRefChem:555624572-09-82,3,4,6-Tetra-O-acetyl-alpha-D-glucopyranosyl bromideAcetobromglucoseacetobromoglucoseAcetobromo-alpha-D-glucoseC14H19BrO9MFCD000632542,3,4,6-Tetra-O-acetyl-|A-D-glucopyranosyl bromide[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-bromooxan-2-yl]methyl acetate[(2R,3R,4S,5R,6R)-3,4,5-tris(acetyloxy)-6-bromooxan-2-yl]methyl acetateETH4010665a-acetobromglucose(2R,3R,4S,5R,6R)-2-(Acetoxymethyl)-6-bromotetrahydro-2H-pyran-3,4,5-triyl triacetateBromo 2,3,4,6-Tetra-O-acetyl-alpha-D-glucopyranosideAcetobromo glucoseBromo 2,3,4,6-Tetra-O-acetyl-Alpha-D-glucopyranoside (~ 5% CaCO3 as stabilizer)UNII-ETH4010665d-acetobromoglucoseEINECS 209-339-0Acetobromo-|A-D-glucose2,3,4,6-tetra-O-acetyl-?-D-glucopyranosyl bromideACETOBROMGLUCOSE [MI]SCHEMBL989356orb2942009CYAYKKUWALRRPA-RGDJUOJXSA-NDTXSID001031860ACETOBROMO-.ALPHA.-D-GLUCOSE
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