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90389-51-8 | 1-(3-Bromophenyl);-N-methylmethanamine hydrochloride
CAS No: 90389-51-8 Catalog No: AG003T6M MDL No:MFCD07106799
Product Description
Catalog Number:
AG003T6M
Chemical Name:
1-(3-Bromophenyl);-N-methylmethanamine hydrochloride
CAS Number:
90389-51-8
Molecular Formula:
C8H11BrClN
Molecular Weight:
236.5366
MDL Number:
MFCD07106799
IUPAC Name:
1-(3-bromophenyl)-N-methylmethanamine;hydrochloride
InChI:
InChI=1S/C8H10BrN.ClH/c1-10-6-7-3-2-4-8(9)5-7;/h2-5,10H,6H2,1H3;1H
InChI Key:
RTANEIHCHYBEKK-UHFFFAOYSA-N
SMILES:
CNCc1cccc(c1)Br.Cl
Properties
Complexity:
95.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.976g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
236.537g/mol
Monoisotopic Mass:
234.976g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Benzylamines: synthesis and evaluation of antimycobacterial properties. | Journal of medicinal chemistry 19840901 |
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