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152814-26-1 | 3-Bromo-N-methylaniline hydrochloride
CAS No: 152814-26-1 Catalog No: AG003T5P MDL No:MFCD12756434
Product Description
Catalog Number:
AG003T5P
Chemical Name:
3-Bromo-N-methylaniline hydrochloride
CAS Number:
152814-26-1
Molecular Formula:
C7H9BrClN
Molecular Weight:
222.5101
MDL Number:
MFCD12756434
IUPAC Name:
3-bromo-N-methylaniline;hydrochloride
InChI:
InChI=1S/C7H8BrN.ClH/c1-9-7-4-2-3-6(8)5-7;/h2-5,9H,1H3;1H
InChI Key:
FRRICFXYDFQOTA-UHFFFAOYSA-N
SMILES:
CNc1cccc(c1)Br.Cl
Properties
Complexity:
85
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.961g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
222.51g/mol
Monoisotopic Mass:
220.961g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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