Cas no 23802-21-3 (Phenol,2-[(3,4-dichlorophenyl)methyl]-4-(1-methylpropyl)-)
23802-21-3 structure
Product Name:Phenol,2-[(3,4-dichlorophenyl)methyl]-4-(1-methylpropyl)-
CAS No:23802-21-3
MF:C17H18Cl2O
MW:309.230223178864
CID:255121
PubChem ID:212013
Update Time:2025-04-19
Phenol,2-[(3,4-dichlorophenyl)methyl]-4-(1-methylpropyl)- Chemical and Physical Properties
Names and Identifiers
-
- Phenol,2-[(3,4-dichlorophenyl)methyl]-4-(1-methylpropyl)-
- 4-butan-2-yl-2-[(3,4-dichlorophenyl)methyl]phenol
- 4-sec-Butyl-alpha-(3,4-dichlorophenyl)-o-cresol
- 2-(3',4'-Dichlorobenzyl)-4-s-butylphenol
- o-Cresol, 4-sec-butyl-alpha-(3,4-dichlorophenyl)-
- 4-(Butan-2-yl)-2-[(3,4-dichlorophenyl)methyl]phenol
- DTXSID30946604
- 23802-21-3
-
- Inchi: 1S/C17H18Cl2O/c1-3-11(2)13-5-7-17(20)14(10-13)8-12-4-6-15(18)16(19)9-12/h4-7,9-11,20H,3,8H2,1-2H3
- InChI Key: ZGAQOIQSCCPGHY-UHFFFAOYSA-N
- SMILES: ClC1=C(C=CC(=C1)CC1=C(C=CC(=C1)C(C)CC)O)Cl
Computed Properties
- Exact Mass: 308.07364
- Monoisotopic Mass: 308.0734706g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
- Complexity: 297
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 6.4
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- PSA: 20.23
Phenol,2-[(3,4-dichlorophenyl)methyl]-4-(1-methylpropyl)- Related Literature
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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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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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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