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1134541-61-9 | Benzenemethanamine, 4-amino-2-fluoro-N,N-dimethyl-
CAS No: 1134541-61-9 Catalog No: AG0008N5 MDL No:MFCD20411317
Product Description
Catalog Number:
AG0008N5
Chemical Name:
Benzenemethanamine, 4-amino-2-fluoro-N,N-dimethyl-
CAS Number:
1134541-61-9
Molecular Formula:
C9H13FN2
Molecular Weight:
168.2113
MDL Number:
MFCD20411317
IUPAC Name:
4-[(dimethylamino)methyl]-3-fluoroaniline
InChI:
InChI=1S/C9H13FN2/c1-12(2)6-7-3-4-8(11)5-9(7)10/h3-5H,6,11H2,1-2H3
InChI Key:
NREHYFFERQGKGJ-UHFFFAOYSA-N
SMILES:
CN(Cc1ccc(cc1F)N)C
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.106g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.215g/mol
Monoisotopic Mass:
168.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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