Cas no 18811-78-4 (1,2-Benzenediol,4,4'-(1-methylethylidene)bis-)
18811-78-4 structure
Product Name:1,2-Benzenediol,4,4'-(1-methylethylidene)bis-
CAS No:18811-78-4
MF:C15H16O4
MW:260.285144805908
CID:123190
PubChem ID:13599489
Update Time:2025-04-18
1,2-Benzenediol,4,4'-(1-methylethylidene)bis- Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Benzenediol,4,4'-(1-methylethylidene)bis-
- 4,4''-ISOPROPYLIDENEDICATECHOL
- 4-[2-(3,4-dihydroxyphenyl)propan-2-yl]benzene-1,2-diol
- 4,4'-Propane-2,2-diyldibenzene-1,2-diol
- DTXSID30544720
- SCHEMBL1501111
- 18811-78-4
- 4-[1-(3,4-dihydroxyphenyl)-1-methyl-ethyl]benzene-1,2-diol
- 4,4'-(Propane-2,2-diyl)di(benzene-1,2-diol)
-
- Inchi: 1S/C15H16O4/c1-15(2,9-3-5-11(16)13(18)7-9)10-4-6-12(17)14(19)8-10/h3-8,16-19H,1-2H3
- InChI Key: VZHGHOOLQWRHIG-UHFFFAOYSA-N
- SMILES: OC1=C(C=CC(=C1)C(C)(C)C1C=CC(=C(C=1)O)O)O
Computed Properties
- Exact Mass: 260.10488
- Monoisotopic Mass: 260.10485899g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 277
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.3
- Topological Polar Surface Area: 80.9?2
Experimental Properties
- Density: 1.325
- Boiling Point: 498.7°C at 760 mmHg
- Flash Point: 243.3°C
- Refractive Index: 1.653
- PSA: 80.92
1,2-Benzenediol,4,4'-(1-methylethylidene)bis- Related Literature
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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