200,000+ products from a single source!
sales@angenechem.com
76163-95-6 | Propanoic acid,2,2-dimethyl-, [(1R,5S)-6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl]methyl ester
CAS No: 76163-95-6 Catalog No: AG005FEZ MDL No:
Product Description
Catalog Number:
AG005FEZ
Chemical Name:
Propanoic acid,2,2-dimethyl-, [(1R,5S)-6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl]methyl ester
CAS Number:
76163-95-6
Molecular Formula:
C15H24O2
Molecular Weight:
236.3499
IUPAC Name:
[(1R,5S)-6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl]methyl 2,2-dimethylpropanoate
InChI:
InChI=1S/C15H24O2/c1-14(2,3)13(16)17-9-10-6-7-11-8-12(10)15(11,4)5/h6,11-12H,7-9H2,1-5H3/t11-,12-/m0/s1
InChI Key:
YWSLSUSMWVPGSE-RYUDHWBXSA-N
SMILES:
O=C(C(C)(C)C)OCC1=CC[C@H]2C[C@@H]1C2(C)C
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
236.178g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.355g/mol
Monoisotopic Mass:
236.178g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.