AC1L41RR structure

AC1L41RR

ethane-1,2-diol;2-(2-hydroxyethoxy)ethanol;(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-methoxyoxane-3,4,5-triol;2-methyloxirane;oxirane;terephthalic acid

Also Known As: .alpha.-D-Glucopyranoside, methyl, polymer with 1,4-benzenedicarboxylic acid, 1,2-ethanediol, methyloxirane, oxirane and 2,2'-oxybis[ethanol]|(C8-H6-O4.C7-H14-O6.C4-H10-O3.C3-H6-O.C2-H6-O2.C2-H4-O)x-|?-D-Glucopyranoside, methyl, polymer with 1,4-benzenedicarboxylic acid, 1,2-ethanediol, methyloxirane, oxirane and 2,2'-oxybis[ethanol]|alpha-D-Glucopyranoside, methyl, polymer with 1,4-benzenedicarboxylic acid, 1,2-ethanediol, 2-methyloxirane, oxirane and 2,2'-oxybis(ethanol)|alpha-D-Glucopyranoside, methyl, polymer with 1,4-benzenedicarboxylic acid, 1,2-ethanediol, methyloxirane, oxirane and 2,2'-oxybis(ethanol)|ethane-1,2-diol; 2-(2-hydroxyethoxy)ethanol; (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-methoxyoxane-3,4,5-triol; 2-methyloxirane; oxirane; terephthalic acid

CAS: 99770-02-2
Molecular Formula C26H46O17
Molecular Weight 630.2735 g/mol
LogP -3.104
Topological Polar Surface Area 289.0 Ų
Hydrogen Bond Donors 10
Hydrogen Bond Acceptors 17
Rotatable Bonds 9
Exact Mass 630.2735
Monoisotopic Mass 630.2735
Heavy Atoms 43
Complexity 401.0

Chemical Identifiers

CAS Number 99770-02-2
SMILES CC1CO1.CO[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O.C1CO1.C1=CC(=CC=C1C(=O)O)C(=O)O.C(CO)O.C(COCCO)O
InChIKey DVVVAOYJBXAQNQ-INBSTMBBSA-N

Product Overview

AC1L41RR (CAS 99770-02-2), with molecular formula C26H46O17 and molecular weight 630.2735 g/mol. IUPAC: ethane-1,2-diol;2-(2-hydroxyethoxy)ethanol;(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-methoxyoxane-3,4,5-triol;2-methyloxirane;oxirane;terephthalic acid.

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