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1243460-09-4 | Phenol, 3-(aminomethyl)-4-bromo-
CAS No: 1243460-09-4 Catalog No: AG000LWG MDL No:MFCD09999802
Product Description
Catalog Number:
AG000LWG
Chemical Name:
Phenol, 3-(aminomethyl)-4-bromo-
CAS Number:
1243460-09-4
Molecular Formula:
C7H8BrNO
Molecular Weight:
202.0485
MDL Number:
MFCD09999802
IUPAC Name:
3-(aminomethyl)-4-bromophenol
InChI:
InChI=1S/C7H8BrNO/c8-7-2-1-6(10)3-5(7)4-9/h1-3,10H,4,9H2
InChI Key:
ROSWINSPQZNXHU-UHFFFAOYSA-N
SMILES:
NCc1cc(O)ccc1Br
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.979g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
202.051g/mol
Monoisotopic Mass:
200.979g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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