200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 137394-65-1
137394-65-1 | Hexanoic acid, 3-hydroxy-2,2-dimethyl-, ethyl ester
CAS No: 137394-65-1 Catalog No: AG00138V MDL No:
Product Description
Catalog Number:
AG00138V
Chemical Name:
Hexanoic acid, 3-hydroxy-2,2-dimethyl-, ethyl ester
CAS Number:
137394-65-1
Molecular Formula:
C10H20O3
Molecular Weight:
188.2640
IUPAC Name:
ethyl 3-hydroxy-2,2-dimethylhexanoate
InChI:
InChI=1S/C10H20O3/c1-5-7-8(11)10(3,4)9(12)13-6-2/h8,11H,5-7H2,1-4H3
InChI Key:
BWKVMAVUBDWUJF-UHFFFAOYSA-N
SMILES:
CCCC(C(C(=O)OCC)(C)C)O
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.141g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.267g/mol
Monoisotopic Mass:
188.141g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.