Home Aminos 4-[methyl(propan-2-yl)amino]benzoic acid hydrochloride

4-[methyl(propan-2-yl)amino]benzoic acid hydrochloride

CAS No.:
1235439-72-1
Catalog Number:
AG01A7RM
Molecular Formula:
C11H16ClNO2
Molecular Weight:
229.7032
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Product Description
Catalog Number:
AG01A7RM
Chemical Name:
4-[methyl(propan-2-yl)amino]benzoic acid hydrochloride
CAS Number:
1235439-72-1
Molecular Formula:
C11H16ClNO2
Molecular Weight:
229.7032
MDL Number:
MFCD16039999
IUPAC Name:
4-[methyl(propan-2-yl)amino]benzoic acid;hydrochloride
InChI:
InChI=1S/C11H15NO2.ClH/c1-8(2)12(3)10-6-4-9(5-7-10)11(13)14;/h4-8H,1-3H3,(H,13,14);1H
InChI Key:
WVDPPCUJKRQZQQ-UHFFFAOYSA-N
SMILES:
CC(N(c1ccc(cc1)C(=O)O)C)C.Cl
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.087g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
229.704g/mol
Monoisotopic Mass:
229.087g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties