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(2R,3S)-butane-1,2,3,4-tetracarboxylic acid

(2R,3S)-butane-1,2,3,4-tetracarboxylic acid

CAS: 4534-68-3

Formula: C8H10O8

SMILES: OC(=O)C[C@@H]([C@@H](CC(O)=O)C(O)=O)C(O)=O

IUPAC: (2R,3S)-butane-1,2,3,4-tetracarboxylic acid

InChI: InChI=1S/C8H10O8/c9-5(10)1-3(7(13)14)4(8(15)16)2-6(11)12/h3-4H,1-2H2,(H,9,10)(H,11,12)(H,13,14)(H,15,16)/t3-,4+

Composition: C (41.04%), H (4.30%), O (54.66%)

Molar Mass: 234.16

Atom Count: 26

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 234.037567282
Formal Charge 0
FSP3 0.5
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 8
Hydrogen Bond Donor Count 4
InChIKey GGAUUQHSCNMCAU-ZXZARUISSA-N
Lipinski's Rule of Five 1
Molar Refractivity 45.22
Topological Polar Surface Area 149.2
Polarizability 18.09
Ring Count 0
Rotatable Bond Count 7

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