200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 3139-05-7
3139-05-7 | 2,5-Dimethyl-4-nitrophenol
CAS No: 3139-05-7 Catalog No: AG003FZM MDL No:MFCD07357405
Product Description
Catalog Number:
AG003FZM
Chemical Name:
2,5-Dimethyl-4-nitrophenol
CAS Number:
3139-05-7
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
MDL Number:
MFCD07357405
IUPAC Name:
2,5-dimethyl-4-nitrophenol
InChI:
InChI=1S/C8H9NO3/c1-5-4-8(10)6(2)3-7(5)9(11)12/h3-4,10H,1-2H3
InChI Key:
DSWZKAODNLLINU-UHFFFAOYSA-N
SMILES:
Cc1cc([N+](=O)[O-])c(cc1O)C
NSC Number:
135201
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.058g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
167.164g/mol
Monoisotopic Mass:
167.058g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.