200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 6617-33-0
6617-33-0 | Bicyclo[4.1.0]hept-4-en-3-one, 4,7,7-trimethyl-, (1R)-
CAS No: 6617-33-0 Catalog No: AG00H7DF MDL No:
Product Description
Catalog Number:
AG00H7DF
Chemical Name:
Bicyclo[4.1.0]hept-4-en-3-one, 4,7,7-trimethyl-, (1R)-
CAS Number:
6617-33-0
Molecular Formula:
C10H14O
Molecular Weight:
150.2176
IUPAC Name:
(1R)-4,7,7-trimethylbicyclo[4.1.0]hept-4-en-3-one
InChI:
InChI=1S/C10H14O/c1-6-4-7-8(5-9(6)11)10(7,2)3/h4,7-8H,5H2,1-3H3/t7?,8-/m1/s1
InChI Key:
CTZWGIMYGKDLPH-BRFYHDHCSA-N
SMILES:
O=C1C[C@@H]2C(C=C1C)C2(C)C
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
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:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Related Products
© 2019 Angene International Limited. All rights Reserved.