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Molecule
2-Hydroxy-2-Methyl-1-Phenylpropan-1-One
CAS: 7473-98-5 · C10H12O2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 7473-98-5
- Molecular Formula
- C10H12O2
- Molecular Mass
- 164.20 g/mol
Identifiers
CAS Registry Number
7473-98-5
SMILES
CC(C)(O)C(=O)c1ccccc1
InChI Key
XMLYCEVDHLAQEL-UHFFFAOYSA-N
InChI
InChI=1S/C10H12O2/c1-10(2,12)9(11)8-6-4-3-5-7-8/h3-7,12H,1-2H3
Names and Synonyms
- 2-Hydroxy-2-Methyl-1-Phenylpropan-1-One Systematic Name
- EM 1173 Synonym
- Darocur 1173 Synonym
- 1-Propanone, 2-hydroxy-2-methyl-1-phenyl- Synonym
- Propiophenone, 2-hydroxy-2-methyl- Synonym
- 2-Hydroxy-2-methyl-1-phenyl-1-propanone Synonym
- 2-Hydroxy-2-methylpropiophenone Synonym
- α-Hydroxyisobutyrophenone Synonym
- 2-Benzoyl-2-propanol Synonym
- 1-Phenyl-2-hydroxy-2-methyl-1-propanone Synonym
- 2-Hydroxy-2-benzoylpropane Synonym
- 2-Hydroxy-2-methyl-1-phenylpropanone Synonym
- 2-Hydroxy-2,2-dimethylacetophenone Synonym
- 1-Hydroxy-1-methylethyl phenyl ketone Synonym
- α-Hydroxy-α-methylpropiophenone Synonym
- UV 1173 Synonym
- 2-Hydroxy-2-methyl-1-phenylpropane-1-one Synonym
- DC 1173 Synonym
- Irgacure 1173 Synonym
- α-Hydroxy-α,α-dimethylacetophenone Synonym
- 2-Benzoyl-2-hydroxypropane Synonym
- I 1173 Synonym
- 1-Phenyl-2-methyl-2-hydroxypropanone Synonym
- Chivacure 173 Synonym
- NSC 401744 Synonym
- FirstCure HMPP Synonym
- Benacure 1173 Synonym
- D 1173 Synonym
- Darocur 173 Synonym
- SR 1121 Synonym
- Sarcure 1121 Synonym
- Micure HP 8 Synonym
- IHT-PI 1173 Synonym
- 2-Methyl-2-hydroxy-1-phenyl-1-propanone Synonym
- Omnirad 73 Synonym
- Runtecure 1103 Synonym
- Additol HDMAP Synonym
- DAR 1173 Synonym
- α,α-Dimethyl-α-hydroxyacetophenone Synonym
- Runtecure 1173 Synonym
- Ciba 1173 Synonym
- Photocure 1173 Synonym
- Genocure DMHA Synonym
- 2-Hydroxy-2-methyl-1-propiophenone Synonym
- 2-Hydroxy-2-methyl-propylphenone Synonym
- Doublecure 173 Synonym
- IHT-PI 6022 Synonym
- IHT-PI PBZ Synonym
- UV 636 Synonym
- Genocure DHMA Synonym
- Esacure KL 200 Synonym
- H 0991 Synonym
- Darocur DR 1173 Synonym
- 2-Hydroxy-2-methyl-1-phenylpropan-1-one Synonym
- Chemcure 73 Synonym
- 1173HMPE Synonym
- Photoinitiator 1173 Synonym
- AgiSyn 1810 Synonym
- IRG 1173 Synonym
- HMPP Synonym
- Methyl-1-phenylpropan-1-one Synonym
- JRCure 1103 Synonym
- 2,2-Dimethyl-2-hydroxyacetophenone Synonym
- Boxing 1173 Synonym
- Doublecure 1173 Synonym
- JRcure 1173 Synonym
- 2-Hydroxy-methylphenylpropan-1-one Synonym
- 2-Hydroxy-2-methylphenylpropanone Synonym
- API 1173 Synonym
- Hydroxy dimethyl acetophenone Synonym
- 2-Methyl-3-phenyl-3-oxopropan-2-ol Synonym
- Omnirad 1173 Synonym
- IC 1173 Synonym
- MV 5002 Synonym
- Photo 1173 Synonym
- Darocur 1137 Synonym
- Gencure 1173 Synonym
- Darocur 1173D Synonym
- Photoinitiator 1173D Synonym
- IGM 1173 Synonym
- PI 1173 Synonym
- Lunacure 100 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 164.20 g/mol | CAS Common Chemistry |
| 164.204 g/mol | RDKit | |
| Density | 1.08 g/cm³ | CAS Common Chemistry |
| 1.0775 g/cm3 @ 20 °C | CAS Common Chemistry | |
| Canonical SMILES | O=C(C=1C=CC=CC1)C(O)(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C10H12O2/c1-10(2,12)9(11)8-6-4-3-5-7-8/h3-7,12H,1-2H3 | CAS Common Chemistry |
| InChI Key | InChIKey=XMLYCEVDHLAQEL-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | >186 °C | CAS Common Chemistry |
| Name | 2-Hydroxy-2-methyl-1-phenylpropan-1-one | CAS Common Chemistry |
| Heavy Atom Count | 12 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 37.3 Ų | RDKit |
| LogP | 1.6401999999999999 | RDKit |
| 1.6402 | RDKit | |
| Molar Refractivity | 47.07030000000003 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.3 | RDKit |
| Exact Mass | 164.083729624 g/mol | RDKit |
| Boiling Point | 116-118 °C @ 11 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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200 ppm
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| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
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Quick conversion
MW = 164.20 g/mol; density = 1.080 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C10H12O2.
