Cas no 3077-14-3 (2-Propanol,1-[(4-methylphenyl)amino]-)
3077-14-3 structure
Product Name:2-Propanol,1-[(4-methylphenyl)amino]-
CAS No:3077-14-3
MF:C10H15NO
MW:165.232202768326
CID:294720
PubChem ID:18674580
Update Time:2025-04-19
2-Propanol,1-[(4-methylphenyl)amino]- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propanol,1-[(4-methylphenyl)amino]-
- 2-Propanol,1-p-toluidino- (7CI,8CI)
- 1-(4-methylanilino)propan-2-ol
- 3077-14-3
- SCHEMBL5713045
- DTXSID30595494
- CHEMBL1269215
-
- Inchi: 1S/C10H15NO/c1-8-3-5-10(6-4-8)11-7-9(2)12/h3-6,9,11-12H,7H2,1-2H3
- InChI Key: ORNUEAWHALNPHU-UHFFFAOYSA-N
- SMILES: OC(C)CNC1C=CC(C)=CC=1
Computed Properties
- Exact Mass: 165.11545
- Monoisotopic Mass: 165.115364102g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 119
- 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: 2
- Topological Polar Surface Area: 32.3?2
Experimental Properties
- PSA: 32.26
2-Propanol,1-[(4-methylphenyl)amino]- Related Literature
-
Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
-
Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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