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Home > Aldehydes > 151446-28-5
151446-28-5 | Benzaldehyde, 2-amino-3-bromo-5-methyl-
CAS No: 151446-28-5 Catalog No: AG001NBV MDL No:
Product Description
Catalog Number:
AG001NBV
Chemical Name:
Benzaldehyde, 2-amino-3-bromo-5-methyl-
CAS Number:
151446-28-5
Molecular Formula:
C8H8BrNO
Molecular Weight:
214.0592
IUPAC Name:
2-amino-3-bromo-5-methylbenzaldehyde
InChI:
InChI=1S/C8H8BrNO/c1-5-2-6(4-11)8(10)7(9)3-5/h2-4H,10H2,1H3
InChI Key:
YGTPLJBXIOJOPK-UHFFFAOYSA-N
SMILES:
O=Cc1cc(C)cc(c1N)Br
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.979g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
214.062g/mol
Monoisotopic Mass:
212.979g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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