Cas no 30124-09-5 (Benzeneethanol, 2-[(2,6-dichlorophenyl)amino]-)
30124-09-5 structure
Product Name:Benzeneethanol, 2-[(2,6-dichlorophenyl)amino]-
CAS No:30124-09-5
MF:C14H13Cl2NO
MW:282.165121793747
CID:1441260
PubChem ID:22294737
Update Time:2025-04-20
Benzeneethanol, 2-[(2,6-dichlorophenyl)amino]- Chemical and Physical Properties
Names and Identifiers
-
- Benzeneethanol, 2-[(2,6-dichlorophenyl)amino]-
- 2-[2-(2,6-dichloroanilino)phenyl]ethanol
- 2-{2-[(2,6-DICHLOROPHENYL)AMINO]PHENYL}ETHANOL
- CHEMBL109777
- 2-[2-(2,6-Dichloroanilino)phenyl]ethan-1-ol
- 30124-09-5
- DTXSID10624493
- NS00116754
- SCHEMBL21724927
-
- Inchi: 1S/C14H13Cl2NO/c15-11-5-3-6-12(16)14(11)17-13-7-2-1-4-10(13)8-9-18/h1-7,17-18H,8-9H2
- InChI Key: NFWJEEBVQAMWHK-UHFFFAOYSA-N
- SMILES: ClC1C=CC=C(C=1NC1C=CC=CC=1CCO)Cl
Computed Properties
- Exact Mass: 281.03759
- Monoisotopic Mass: 281.0374194g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 4
- Complexity: 242
- 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: 4.5
- Topological Polar Surface Area: 32.3?2
Experimental Properties
- PSA: 32.26
Benzeneethanol, 2-[(2,6-dichlorophenyl)amino]- Related Literature
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
-
Jason Wan Lab Chip, 2020,20, 4528-4538
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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