200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 76779-13-0
76779-13-0 | Bicyclo[3.2.1]oct-6-en-3-one, 2,7-dimethyl-
CAS No: 76779-13-0 Catalog No: AG005UQ3 MDL No:
Product Description
Catalog Number:
AG005UQ3
Chemical Name:
Bicyclo[3.2.1]oct-6-en-3-one, 2,7-dimethyl-
CAS Number:
76779-13-0
Molecular Formula:
C10H14O
Molecular Weight:
150.2176
IUPAC Name:
2,7-dimethylbicyclo[3.2.1]oct-6-en-3-one
InChI:
InChI=1S/C10H14O/c1-6-3-8-4-9(6)7(2)10(11)5-8/h3,7-9H,4-5H2,1-2H3
InChI Key:
SPTCQXAFSVTXMJ-UHFFFAOYSA-N
SMILES:
O=C1CC2C=C(C(C1C)C2)C
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.104g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.221g/mol
Monoisotopic Mass:
150.104g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Related Products
© 2019 Angene International Limited. All rights Reserved.