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methyl 2-amino-2-phenylbutanoate

methyl 2-amino-2-phenylbutanoate

CAS: 76142-47-7

Formula: C11H15NO2

SMILES: CCC(N)(C(=O)OC)C1=CC=CC=C1

IUPAC: methyl 2-amino-2-phenylbutanoate

InChI: InChI=1/C11H15NO2/c1-3-11(12,10(13)14-2)9-7-5-4-6-8-9/h4-8H,3,12H2,1-2H3

Composition: C (68.37%), H (7.82%), N (7.25%), O (16.56%)

Molar Mass: 193.246

Atom Count: 29

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 193.110278727
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey URYMDIRNRNJHAM-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.37
Topological Polar Surface Area 52.32
Polarizability 21.82
Ring Count 1
Rotatable Bond Count 4

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95% <2 Days 76142-47-7 $132.19-$396.58$132.19$132.19$235.98$235.98$396.58$396.58
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