3-Bromo-2-methylphenol - CAS 7766-23-6
Catalog: |
BB071344 |
Product Name: |
3-Bromo-2-methylphenol |
CAS: |
7766-23-6 |
Synonyms: |
2-Bromo-6-hydroxytoluene; 2-Methyl-3-bromophenol |
IUPAC Name: | 3-bromo-2-methylphenol |
Description: | 3-Bromo-2-methylphenol |
Molecular Weight: | 187.03 |
Molecular Formula: | C7H7BrO |
Canonical SMILES: | CC1=C(C=CC=C1Br)O |
InChI: | InChI=1S/C7H7BrO/c1-5-6(8)3-2-4-7(5)9/h2-4,9H,1H3 |
InChI Key: | WPDXAMRGYMDTOV-UHFFFAOYSA-N |
Melting Point: | 89-93°C |
Solubility: | Chloroform (Slightly), Methanol (Slightly) |
Appearance: | Off-White Solid |
Storage: | 20°C |
GHS Hazard Statement: | H302 (50%): 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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 94.9 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 185.96803 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 185.96803 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 20.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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