Home Aminos tert-butyl 2-(aminomethyl)benzoate hydrochloride

tert-butyl 2-(aminomethyl)benzoate hydrochloride

CAS No.:
916198-63-5
Catalog Number:
AG01BRH5
Molecular Formula:
C12H18ClNO2
Molecular Weight:
243.7298
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Product Description
Catalog Number:
AG01BRH5
Chemical Name:
tert-butyl 2-(aminomethyl)benzoate hydrochloride
CAS Number:
916198-63-5
Molecular Formula:
C12H18ClNO2
Molecular Weight:
243.7298
MDL Number:
MFCD29922016
IUPAC Name:
tert-butyl 2-(aminomethyl)benzoate;hydrochloride
InChI:
InChI=1S/C12H17NO2.ClH/c1-12(2,3)15-11(14)10-7-5-4-6-9(10)8-13;/h4-7H,8,13H2,1-3H3;1H
InChI Key:
BTAMGZZVBVUADC-UHFFFAOYSA-N
SMILES:
NCc1ccccc1C(=O)OC(C)(C)C.Cl
Properties
Complexity:
220  
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:
4  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties