2-(4-Bromophenyl)-2-propanol - CAS 2077-19-2
Catalog: |
BB016270 |
Product Name: |
2-(4-Bromophenyl)-2-propanol |
CAS: |
2077-19-2 |
Synonyms: |
2-(4-bromophenyl)-2-propanol; 2-(4-bromophenyl)propan-2-ol |
IUPAC Name: | 2-(4-bromophenyl)propan-2-ol |
Description: | 2-(4-Bromophenyl)-2-propanol (CAS# 2077-19-2) is a useful research chemical. |
Molecular Weight: | 215.09 |
Molecular Formula: | C9H11BrO |
Canonical SMILES: | CC(C)(C1=CC=C(C=C1)Br)O |
InChI: | InChI=1S/C9H11BrO/c1-9(2,11)7-3-5-8(10)6-4-7/h3-6,11H,1-2H3 |
InChI Key: | AOGYBHJTXLXRSM-UHFFFAOYSA-N |
Boiling Point: | 281.535 ℃ at 760 mmHg |
Density: | 1.403 g/cm3 |
Solubility: | Slightly soluble in water (1.4 g/L) (25℃) |
Appearance: | White solid |
MDL: | MFCD11870096 |
LogP: | 2.67650 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111675599-A | Method for catalyzing and oxidizing aromatic benzyl tertiary C-H bond into tertiary alcohol by metalloporphyrin | 20200427 |
WO-2021191384-A1 | Aryl piperidines as monoacylglycerol lipase modulators | 20200326 |
WO-2021020363-A1 | Heterocyclic compound | 20190729 |
WO-2020168143-A1 | Substituted bicyclic compounds as farnesoid x receptor modulators | 20190215 |
TW-202045498-A | Substituted bicyclic compounds as farnesoid x receptor modulators | 20190215 |
Complexity: | 126 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 213.99933 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 213.99933 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 20.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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