Cas no 55667-48-6 (N,N,N'-Trimethyl-N'-phenyl-1,3-propanediamine)
55667-48-6 structure
Product Name:N,N,N'-Trimethyl-N'-phenyl-1,3-propanediamine
CAS No:55667-48-6
MF:C12H20N2
MW:192.300602912903
CID:1594975
PubChem ID:559076
Update Time:2025-04-21
N,N,N'-Trimethyl-N'-phenyl-1,3-propanediamine Chemical and Physical Properties
Names and Identifiers
-
- N,N,N'-Trimethyl-N'-phenyl-1,3-propanediamine
- 1,3-Propanediamine, N,N,N'-trimethyl-N'-phenyl-
- SCHEMBL21448012
- 55667-48-6
- BZVVCAJOMPKFFI-UHFFFAOYSA-N
-
- Inchi： 1S/C12H20N2/c1-13(2)10-7-11-14(3)12-8-5-4-6-9-12/h4-6,8-9H,7,10-11H2,1-3H3
- InChI Key： BZVVCAJOMPKFFI-UHFFFAOYSA-N
- SMILES： N(C)(C1C=CC=CC=1)CCCN(C)C
Computed Properties
- Exact Mass: 192.162648646g/mol
- Monoisotopic Mass: 192.162648646g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 5
- Complexity: 139
- 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: 2.4
- Topological Polar Surface Area: 6.5?2
N,N,N'-Trimethyl-N'-phenyl-1,3-propanediamine Related Literature
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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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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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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