200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 14705-50-1
14705-50-1 | 3-Hexanone, 2,2,5-trimethyl-
CAS No: 14705-50-1 Catalog No: AG001EKB MDL No:MFCD12153388
Product Description
Catalog Number:
AG001EKB
Chemical Name:
3-Hexanone, 2,2,5-trimethyl-
CAS Number:
14705-50-1
Molecular Formula:
C9H18O
Molecular Weight:
142.2386
MDL Number:
MFCD12153388
IUPAC Name:
2,2,5-trimethylhexan-3-one
InChI:
InChI=1S/C9H18O/c1-7(2)6-8(10)9(3,4)5/h7H,6H2,1-5H3
InChI Key:
LXFHNTKYSUCXRB-UHFFFAOYSA-N
SMILES:
CC(CC(=O)C(C)(C)C)C
NSC Number:
28029
Properties
Complexity:
117
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.136g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.242g/mol
Monoisotopic Mass:
142.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.