Home Aminos methyl 3-amino-3-phenylbutanoate

methyl 3-amino-3-phenylbutanoate

CAS No.:
19025-52-6
Catalog Number:
AG01AD63
Molecular Formula:
C11H15NO2
Molecular Weight:
193.2423
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Product Description
Catalog Number:
AG01AD63
Chemical Name:
methyl 3-amino-3-phenylbutanoate
CAS Number:
19025-52-6
Molecular Formula:
C11H15NO2
Molecular Weight:
193.2423
IUPAC Name:
methyl 3-amino-3-phenylbutanoate
InChI:
InChI=1S/C11H15NO2/c1-11(12,8-10(13)14-2)9-6-4-3-5-7-9/h3-7H,8,12H2,1-2H3
InChI Key:
GCSLBFMKJPBNFV-UHFFFAOYSA-N
SMILES:
COC(=O)CC(c1ccccc1)(N)C
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.11g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193.246g/mol
Monoisotopic Mass:
193.11g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties