Home Other Building Blocks 3-{[2-(2,2-dimethylpropanamido)acetyl]oxy}propanoic acid

3-{[2-(2,2-dimethylpropanamido)acetyl]oxy}propanoic acid

CAS No.:
1878761-62-6
Catalog Number:
AG01BTHW
Molecular Formula:
C10H17NO5
Molecular Weight:
231.2457
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Product Description
Catalog Number:
AG01BTHW
Chemical Name:
3-{[2-(2,2-dimethylpropanamido)acetyl]oxy}propanoic acid
CAS Number:
1878761-62-6
Molecular Formula:
C10H17NO5
Molecular Weight:
231.2457
MDL Number:
MFCD30539819
IUPAC Name:
3-[2-(2,2-dimethylpropanoylamino)acetyl]oxypropanoic acid
InChI:
InChI=1S/C10H17NO5/c1-10(2,3)9(15)11-6-8(14)16-5-4-7(12)13/h4-6H2,1-3H3,(H,11,15)(H,12,13)
InChI Key:
ZEGKMIBNIQVSKL-UHFFFAOYSA-N
SMILES:
O=C(CNC(=O)C(C)(C)C)OCCC(=O)O
Properties
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.111g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
231.248g/mol
Monoisotopic Mass:
231.111g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
92.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties