200,000+ products from a single source!
sales@angenechem.com
131783-50-1 | 3-Cyclohexene-1,2-dicarboxylic acid, 5-methyl-, 1-methyl ester
CAS No: 131783-50-1 Catalog No: AG000ZPZ MDL No:
Product Description
Catalog Number:
AG000ZPZ
Chemical Name:
3-Cyclohexene-1,2-dicarboxylic acid, 5-methyl-, 1-methyl ester
CAS Number:
131783-50-1
Molecular Formula:
C10H13O4-
Molecular Weight:
197.2078
IUPAC Name:
6-methoxycarbonyl-4-methylcyclohex-2-ene-1-carboxylate
InChI:
InChI=1S/C10H14O4/c1-6-3-4-7(9(11)12)8(5-6)10(13)14-2/h3-4,6-8H,5H2,1-2H3,(H,11,12)/p-1
InChI Key:
ARYMVPOQTGLXLV-UHFFFAOYSA-M
SMILES:
COC(=O)C1CC(C)C=CC1C(=O)[O-]
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.081g/mol
Formal Charge:
-1
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.21g/mol
Monoisotopic Mass:
197.081g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.