Home Other Building Blocks 2-ETHYL-N-BUTYRIC ACID ETHYL ESTER

2-ETHYL-N-BUTYRIC ACID ETHYL ESTER

CAS No.:
2983-38-2
Catalog Number:
AG003H82
Molecular Formula:
C8H16O2
Molecular Weight:
144.2114
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Product Description
Catalog Number:
AG003H82
Chemical Name:
2-ETHYL-N-BUTYRIC ACID ETHYL ESTER
CAS Number:
2983-38-2
Molecular Formula:
C8H16O2
Molecular Weight:
144.2114
MDL Number:
MFCD00059396
IUPAC Name:
ethyl 2-ethylbutanoate
InChI:
InChI=1S/C8H16O2/c1-4-7(5-2)8(9)10-6-3/h7H,4-6H2,1-3H3
InChI Key:
MJGSLNIPTRPYJV-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(CC)CC
EC Number:
221-044-9
UNII:
9ZB2G5FF44
FEMA Number:
4344
Properties
Complexity:
95.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.115g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
144.214g/mol
Monoisotopic Mass:
144.115g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties