Home Other Building Blocks 2-(2-ethylbutanamido)acetic acid

2-(2-ethylbutanamido)acetic acid

CAS No.:
98552-89-7
Catalog Number:
AG01BEI9
Molecular Formula:
C8H15NO3
Molecular Weight:
173.2096
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Product Description
Catalog Number:
AG01BEI9
Chemical Name:
2-(2-ethylbutanamido)acetic acid
CAS Number:
98552-89-7
Molecular Formula:
C8H15NO3
Molecular Weight:
173.2096
MDL Number:
MFCD09811703
IUPAC Name:
2-(2-ethylbutanoylamino)acetic acid
InChI:
InChI=1S/C8H15NO3/c1-3-6(4-2)8(12)9-5-7(10)11/h6H,3-5H2,1-2H3,(H,9,12)(H,10,11)
InChI Key:
WYBPOIJTBSCBSH-UHFFFAOYSA-N
SMILES:
CCC(C(=O)NCC(=O)O)CC
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.105g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
173.212g/mol
Monoisotopic Mass:
173.105g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties