200,000+ products from a single source!
sales@angenechem.com
19945-14-3 | Butanoic acid, 2-ethyl-2-methyl-, ethyl ester
CAS No: 19945-14-3 Catalog No: AG002C4D MDL No:
Product Description
Catalog Number:
AG002C4D
Chemical Name:
Butanoic acid, 2-ethyl-2-methyl-, ethyl ester
CAS Number:
19945-14-3
Molecular Formula:
C9H18O2
Molecular Weight:
158.2380
IUPAC Name:
ethyl 2-ethyl-2-methylbutanoate
InChI:
InChI=1S/C9H18O2/c1-5-9(4,6-2)8(10)11-7-3/h5-7H2,1-4H3
InChI Key:
NPNMNANLCUXXQR-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(CC)(CC)C
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.131g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.241g/mol
Monoisotopic Mass:
158.131g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^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.