Home Aminos methyl 2-(aminomethyl)-2-phenylbutanoate hydrochloride

methyl 2-(aminomethyl)-2-phenylbutanoate hydrochloride

CAS No.:
1909348-38-4
Catalog Number:
AG01C3CP
Molecular Formula:
C12H18ClNO2
Molecular Weight:
243.7298
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Product Description
Catalog Number:
AG01C3CP
Chemical Name:
methyl 2-(aminomethyl)-2-phenylbutanoate hydrochloride
CAS Number:
1909348-38-4
Molecular Formula:
C12H18ClNO2
Molecular Weight:
243.7298
MDL Number:
MFCD29060408
IUPAC Name:
methyl 2-(aminomethyl)-2-phenylbutanoate;hydrochloride
InChI:
InChI=1S/C12H17NO2.ClH/c1-3-12(9-13,11(14)15-2)10-7-5-4-6-8-10;/h4-8H,3,9,13H2,1-2H3;1H
InChI Key:
CZYZSYMLSSXDOE-UHFFFAOYSA-N
SMILES:
COC(=O)C(c1ccccc1)(CN)CC.Cl
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.103g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
243.731g/mol
Monoisotopic Mass:
243.103g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties