200,000+ products from a single source!
sales@angenechem.com
99067-15-9 | 4-Bromo-2-(1H-pyrazol-3-yl)phenol, 98%
CAS No: 99067-15-9 Catalog No: AG003KV5 MDL No:MFCD03424536
Product Description
Catalog Number:
AG003KV5
Chemical Name:
4-Bromo-2-(1H-pyrazol-3-yl)phenol, 98%
CAS Number:
99067-15-9
Molecular Formula:
C9H7BrN2O
Molecular Weight:
239.0687
MDL Number:
MFCD03424536
IUPAC Name:
4-bromo-2-(1H-pyrazol-5-yl)phenol
InChI:
InChI=1S/C9H7BrN2O/c10-6-1-2-9(13)7(5-6)8-3-4-11-12-8/h1-5,13H,(H,11,12)
InChI Key:
PNIKRSVKWZRJOK-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)c1cc[nH]n1)O
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.974g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
239.072g/mol
Monoisotopic Mass:
237.974g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Related Products
© 2019 Angene International Limited. All rights Reserved.