Home Aminos 3-(aminomethyl)-4-fluorobenzoic acid hydrochloride

3-(aminomethyl)-4-fluorobenzoic acid hydrochloride

CAS No.:
1461707-64-1
Catalog Number:
AG01A61R
Molecular Formula:
C8H9ClFNO2
Molecular Weight:
205.6140
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Product Description
Catalog Number:
AG01A61R
Chemical Name:
3-(aminomethyl)-4-fluorobenzoic acid hydrochloride
CAS Number:
1461707-64-1
Molecular Formula:
C8H9ClFNO2
Molecular Weight:
205.6140
MDL Number:
MFCD25371680
IUPAC Name:
3-(aminomethyl)-4-fluorobenzoic acid;hydrochloride
InChI:
InChI=1S/C8H8FNO2.ClH/c9-7-2-1-5(8(11)12)3-6(7)4-10;/h1-3H,4,10H2,(H,11,12);1H
InChI Key:
SKSZXQNTNYAOEY-UHFFFAOYSA-N
SMILES:
NCc1cc(ccc1F)C(=O)O.Cl
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.031g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
205.613g/mol
Monoisotopic Mass:
205.031g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties