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Home > Other Heterocycles > 29753-02-4
29753-02-4 | 2-Propenoic acid, 2-methyl-, bicyclo[2.2.1]hept-2-yl ester
CAS No: 29753-02-4 Catalog No: AG002ZB1 MDL No:
Product Description
Catalog Number:
AG002ZB1
Chemical Name:
2-Propenoic acid, 2-methyl-, bicyclo[2.2.1]hept-2-yl ester
CAS Number:
29753-02-4
Molecular Formula:
C11H16O2
Molecular Weight:
180.2435
IUPAC Name:
2-bicyclo[2.2.1]heptanyl 2-methylprop-2-enoate
InChI:
InChI=1S/C11H16O2/c1-7(2)11(12)13-10-6-8-3-4-9(10)5-8/h8-10H,1,3-6H2,2H3
InChI Key:
SKKHNUKNMQLBTJ-UHFFFAOYSA-N
SMILES:
CC(=C)C(=O)OC1CC2CC1CC2
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.115g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.247g/mol
Monoisotopic Mass:
180.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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