1,2-dimethyl 4,5-dimethylcyclohex-4-ene-1,2-dicarboxylate

1,2-dimethyl 4,5-dimethylcyclohex-4-ene-1,2-dicarboxylate

CAS: 55264-91-0

Formula: C12H18O4

SMILES: COC(=O)C1CC(C)=C(C)CC1C(=O)OC

IUPAC: 1,2-dimethyl 4,5-dimethylcyclohex-4-ene-1,2-dicarboxylate

InChI: InChI=1/C12H18O4/c1-7-5-9(11(13)15-3)10(6-8(7)2)12(14)16-4/h9-10H,5-6H2,1-4H3

Composition: C (63.70%), H (8.02%), O (28.28%)

Molar Mass: 226.272

Atom Count: 34

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	226.12050906
Formal Charge	0
FSP3	0.67
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	DRIHIJXHHLHRAL-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	59.3
Topological Polar Surface Area	52.6
Polarizability	23.42
Ring Count	1
Rotatable Bond Count	4

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90%	<2 Days	55264-91-0		$51.35-$524.40$51.35$63.37$86.31$524.40