4-Amino-2,5-dimethylphenol - CAS 3096-71-7
Catalog: |
BB020765 |
Product Name: |
4-Amino-2,5-dimethylphenol |
CAS: |
3096-71-7 |
Synonyms: |
4-amino-2,5-dimethylphenol |
IUPAC Name: | 4-amino-2,5-dimethylphenol |
Description: | 4-Amino-2,5-dimethylphenol (CAS# 3096-71-7) is a useful research chemical for chemical synthesis studies. |
Molecular Weight: | 137.18 |
Molecular Formula: | C8H11NO |
Canonical SMILES: | CC1=CC(=C(C=C1O)C)N |
InChI: | InChI=1S/C8H11NO/c1-5-4-8(10)6(2)3-7(5)9/h3-4,10H,9H2,1-2H3 |
InChI Key: | JSWVCUXQICMATE-UHFFFAOYSA-N |
Boiling Point: | 288.4 ℃ at 760 mmHg |
Melting Point: | 242-243 ℃ |
Purity: | 98 % |
Density: | 1.118 g/cm3 |
Appearance: | Solid |
MDL: | MFCD00007873 |
LogP: | 2.17240 |
GHS Hazard Statement: | H302 (99.22%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
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Complexity: | 116 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 137.084063974 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 137.084063974 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 46.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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