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24506-42-1 | 1,1-Cyclopropanedicarboxylic acid, 2,3-dimethyl-, dimethyl ester, cis- (8CI,9CI)
CAS No: 24506-42-1 Catalog No: AG002OCO MDL No:
Product Description
Catalog Number:
AG002OCO
Chemical Name:
1,1-Cyclopropanedicarboxylic acid, 2,3-dimethyl-, dimethyl ester, cis- (8CI,9CI)
CAS Number:
24506-42-1
Molecular Formula:
C9H14O4
Molecular Weight:
186.2051
IUPAC Name:
dimethyl (2R,3S)-2,3-dimethylcyclopropane-1,1-dicarboxylate
InChI:
InChI=1S/C9H14O4/c1-5-6(2)9(5,7(10)12-3)8(11)13-4/h5-6H,1-4H3/t5-,6+
InChI Key:
VTQCBPZJSSCSAC-OLQVQODUSA-N
SMILES:
COC(=O)C1(C(=O)OC)[C@H]([C@H]1C)C
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
186.089g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.207g/mol
Monoisotopic Mass:
186.089g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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