Home Aminos methyl 3-amino-3-(3-methoxyphenyl)butanoate hydrochloride

methyl 3-amino-3-(3-methoxyphenyl)butanoate hydrochloride

CAS No.:
1803587-49-6
Catalog Number:
AG01BBP9
Molecular Formula:
C12H18ClNO3
Molecular Weight:
259.7292
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Product Description
Catalog Number:
AG01BBP9
Chemical Name:
methyl 3-amino-3-(3-methoxyphenyl)butanoate hydrochloride
CAS Number:
1803587-49-6
Molecular Formula:
C12H18ClNO3
Molecular Weight:
259.7292
MDL Number:
MFCD28506084
IUPAC Name:
methyl 3-amino-3-(3-methoxyphenyl)butanoate;hydrochloride
InChI:
InChI=1S/C12H17NO3.ClH/c1-12(13,8-11(14)16-3)9-5-4-6-10(7-9)15-2;/h4-7H,8,13H2,1-3H3;1H
InChI Key:
WQAPWGIZJRRXFP-UHFFFAOYSA-N
SMILES:
COC(=O)CC(c1cccc(c1)OC)(N)C.Cl
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.098g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
259.73g/mol
Monoisotopic Mass:
259.098g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties