200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 3142-58-3
3142-58-3 | 3,3-dimethylpentane-2,4-dione
CAS No: 3142-58-3 Catalog No: AG0033HK MDL No:
Product Description
Catalog Number:
AG0033HK
Chemical Name:
3,3-dimethylpentane-2,4-dione
CAS Number:
3142-58-3
Molecular Formula:
C7H12O2
Molecular Weight:
128.1690
IUPAC Name:
3,3-dimethylpentane-2,4-dione
InChI:
InChI=1S/C7H12O2/c1-5(8)7(3,4)6(2)9/h1-4H3
InChI Key:
SWGDHTSWHSSMLE-UHFFFAOYSA-N
SMILES:
CC(=O)C(C(=O)C)(C)C
EC Number:
221-551-5
NSC Number:
42609
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.084g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
128.171g/mol
Monoisotopic Mass:
128.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.