200,000+ products from a single source!
sales@angenechem.com
89025-17-2 | Heptanoic acid, 4-(acetylamino)-6-methyl-, ethyl ester, (S)-
CAS No: 89025-17-2 Catalog No: AG0044C5 MDL No:
Product Description
Catalog Number:
AG0044C5
Chemical Name:
Heptanoic acid, 4-(acetylamino)-6-methyl-, ethyl ester, (S)-
CAS Number:
89025-17-2
Molecular Formula:
C12H23NO3
Molecular Weight:
229.3159
IUPAC Name:
ethyl 4-acetamido-6-methylheptanoate
InChI:
InChI=1S/C12H23NO3/c1-5-16-12(15)7-6-11(8-9(2)3)13-10(4)14/h9,11H,5-8H2,1-4H3,(H,13,14)
InChI Key:
DMPFCAXDXZXTQA-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC[C@H](NC(=O)C)CC(C)C
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.168g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.32g/mol
Monoisotopic Mass:
229.168g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.