Cas no 885963-22-4 ([1,1'-Biphenyl]-3-carboxaldehyde,3'-chloro-4'-methyl-)
![[1,1'-Biphenyl]-3-carboxaldehyde,3'-chloro-4'-methyl- structure](https://ossimg.kuujia.com/scimg/886000/885963-22-4x500.png)
885963-22-4 structure
Product Name:[1,1'-Biphenyl]-3-carboxaldehyde,3'-chloro-4'-methyl-
CAS No:885963-22-4
MF:C14H11ClO
MW:230.689543008804
CID:711994
PubChem ID:51401307
Update Time:2025-04-19
[1,1'-Biphenyl]-3-carboxaldehyde,3'-chloro-4'-methyl- Chemical and Physical Properties
Names and Identifiers
-
- [1,1'-Biphenyl]-3-carboxaldehyde,3'-chloro-4'-methyl-
- 3-(3-Chloro-4-methylphenyl)benzaldehyde
- [1,1'-Biphenyl]-3-carboxaldehyde,3'-chloro-4'-methyl
- 3-(3-Chloro-5-methylphenyl)benzaldehyde
- 3-(4-Chloro-2-methylphenyl)benzaldehyde
- 3-(5-Chloro-2-methylphenyl)benzaldehyde
- NCGC00373975-01
- 3'-Chloro-4'-methyl[1,1'-biphenyl]-3-carbaldehyde
- AKOS017560218
- 885963-22-4
- DTXSID50680139
-
- Inchi： 1S/C14H11ClO/c1-10-5-6-13(8-14(10)15)12-4-2-3-11(7-12)9-16/h2-9H,1H3
- InChI Key： IONVCUOGOLYMQU-UHFFFAOYSA-N
- SMILES： ClC1C=C(C=CC=1C)C1C=CC=C(C=O)C=1
Computed Properties
- Exact Mass: 230.05000
- Monoisotopic Mass: 230.05
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 241
- 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
- Topological Polar Surface Area: 17.1A^2
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 4
Experimental Properties
- PSA: 17.07000
- LogP: 4.12790
[1,1'-Biphenyl]-3-carboxaldehyde,3'-chloro-4'-methyl- Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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