2-Fluoro-4-methyl-5-nitrophenol - CAS 110298-75-4
Catalog: |
BB063461 |
Product Name: |
2-Fluoro-4-methyl-5-nitrophenol |
CAS: |
110298-75-4 |
Synonyms: |
2-fluoro-4-methyl-5-nitrophenol; 2-Fluoro-4-methyl-5-nitro-phenol |
IUPAC Name: | 2-fluoro-4-methyl-5-nitrophenol |
Description: | 2-Fluoro-4-methyl-5-nitrophenol |
Molecular Weight: | 171.13 |
Molecular Formula: | C7H6FNO3 |
Canonical SMILES: | CC1=CC(=C(C=C1[N+](=O)[O-])O)F |
InChI: | InChI=1S/C7H6FNO3/c1-4-2-5(8)7(10)3-6(4)9(11)12/h2-3,10H,1H3 |
InChI Key: | VYCDLDNAWPSNMM-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 182 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 171.03317122 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 171.03317122 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 66Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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