Home Carboxys 2,3-Oxiranedicarboxylic acid, 2-Methyl-, diMethyl ester,(2R,3R)-rel-

2,3-Oxiranedicarboxylic acid, 2-Methyl-, diMethyl ester,(2R,3R)-rel-

CAS No.:
53282-74-9
Catalog Number:
AG00DB38
Molecular Formula:
C7H10O5
Molecular Weight:
174.1513
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Product Description
Catalog Number:
AG00DB38
Chemical Name:
2,3-Oxiranedicarboxylic acid, 2-Methyl-, diMethyl ester,(2R,3R)-rel-
CAS Number:
53282-74-9
Molecular Formula:
C7H10O5
Molecular Weight:
174.1513
MDL Number:
MFCD25977310
IUPAC Name:
dimethyl (2S,3S)-2-methyloxirane-2,3-dicarboxylate
InChI:
InChI=1S/C7H10O5/c1-7(6(9)11-3)4(12-7)5(8)10-2/h4H,1-3H3/t4-,7+/m1/s1
InChI Key:
IXJAJAOTVFAFBN-FBCQKBJTSA-N
SMILES:
COC(=O)[C@H]1O[C@]1(C)C(=O)OC
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
174.053g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.152g/mol
Monoisotopic Mass:
174.053g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
65.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties