Home Aminos 2-[benzyl(methyl)amino]butanoic acid hydrochloride

2-[benzyl(methyl)amino]butanoic acid hydrochloride

CAS No.:
1803560-77-1
Catalog Number:
AG01B8DO
Molecular Formula:
C12H18ClNO2
Molecular Weight:
243.7298
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Product Description
Catalog Number:
AG01B8DO
Chemical Name:
2-[benzyl(methyl)amino]butanoic acid hydrochloride
CAS Number:
1803560-77-1
Molecular Formula:
C12H18ClNO2
Molecular Weight:
243.7298
MDL Number:
MFCD28348066
IUPAC Name:
2-[benzyl(methyl)amino]butanoic acid;hydrochloride
InChI:
InChI=1S/C12H17NO2.ClH/c1-3-11(12(14)15)13(2)9-10-7-5-4-6-8-10;/h4-8,11H,3,9H2,1-2H3,(H,14,15);1H
InChI Key:
UAOVWBBWZQTPPE-UHFFFAOYSA-N
SMILES:
CCC(C(=O)O)N(Cc1ccccc1)C.Cl
Properties
Complexity:
200  
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:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties