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Home > Other Heterocycles > 138511-35-0
138511-35-0 | 2-Propenoic acid, bicyclo[2.2.1]heptyl ester (9CI)
CAS No: 138511-35-0 Catalog No: AG0019CX MDL No:
Product Description
Catalog Number:
AG0019CX
Chemical Name:
2-Propenoic acid, bicyclo[2.2.1]heptyl ester (9CI)
CAS Number:
138511-35-0
Molecular Formula:
C10H14O2
Molecular Weight:
166.2170
IUPAC Name:
1-bicyclo[2.2.1]heptanyl prop-2-enoate
InChI:
InChI=1S/C10H14O2/c1-2-9(11)12-10-5-3-8(7-10)4-6-10/h2,8H,1,3-7H2
InChI Key:
WGUJUIMHWNHXGB-UHFFFAOYSA-N
SMILES:
C=CC(=O)OC12CCC(C2)CC1
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.099g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.22g/mol
Monoisotopic Mass:
166.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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