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4,4'-Biphenol
CAS: 92-88-6 | C12H10O2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
92-88-6
Molecular Formula:
C12H10O2
Molecular Mass:
186.21 g/mol
Names and Synonyms:
4,4'-Biphenol
[1,1′-Biphenyl]-4,4′-diol
4,4′-Biphenyldiol
ASM DOD
p,p′-Biphenol
4,4′-Dihydroxybiphenyl
4,4′-Dihydroxydiphenyl
p,p′-Diphenol
4,4′-Biphenol
p-Dihydroxydiphenyl
DOD
Antioxidant DOD
4,4′-Dihydroxy-1,1′-biphenyl
p,p′-Dihydroxybiphenyl
4,4′-Bisphenol
4,4′-Diphenol
p-Diphenol
4-(4-Hydroxyphenyl)phenol
BPL
BPL (phenol)
NSC 8711
B 0464
Identifiers:
SMILES:
Oc1ccc(-c2ccc(O)cc2)cc1
InChI:
InChI=1S/C12H10O2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8,13-14H
Key Properties
Melting Point
283 °C
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 186.21 g/mol | CAS Common Chemistry |
| 186.06807956 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/4,4%27-Biphenol | CAS Common Chemistry |
| Canonical SMILES | OC=1C=CC(=CC1)C2=CC=C(O)C=C2 | CAS Common Chemistry |
| InChI | InChI=1S/C12H10O2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8,13-14H | CAS Common Chemistry |
| InChI Key | InChIKey=VCCBEIPGXKNHFW-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 283 °C | CAS Common Chemistry |
| Name | 4,4′-Dihydroxybiphenyl | CAS Common Chemistry |
| 4,4'-Biphenol | CAS Common Chemistry | |
| Heavy Atom Count | 14 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 40.46 Ų | RDKit |
| LogP | 2.764800000000001 | RDKit |
| Molar Refractivity | 55.20760000000003 | RDKit |
