Home Aminos 2-[(1-hydroxybutan-2-yl)amino]propanoic acid

2-[(1-hydroxybutan-2-yl)amino]propanoic acid

CAS No.:
1501996-08-2
Catalog Number:
AG01E9UD
Molecular Formula:
C7H15NO3
Molecular Weight:
161.1989
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Product Description
Catalog Number:
AG01E9UD
Chemical Name:
2-[(1-hydroxybutan-2-yl)amino]propanoic acid
CAS Number:
1501996-08-2
Molecular Formula:
C7H15NO3
Molecular Weight:
161.1989
MDL Number:
MFCD16088582
IUPAC Name:
2-(1-hydroxybutan-2-ylamino)propanoic acid
InChI:
InChI=1S/C7H15NO3/c1-3-6(4-9)8-5(2)7(10)11/h5-6,8-9H,3-4H2,1-2H3,(H,10,11)
InChI Key:
PEAKGWQZHHQCEC-UHFFFAOYSA-N
SMILES:
CCC(NC(C(=O)O)C)CO
Properties
Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.105g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
161.201g/mol
Monoisotopic Mass:
161.105g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.2  
Properties