Cas no 916739-36-1 (BENZENEMETHANAMINE, 4-AMINO-N,N-BIS[(4-AMINOPHENYL)METHYL]-, HYDROCHLORIDE)
916739-36-1 structure
Product Name:BENZENEMETHANAMINE, 4-AMINO-N,N-BIS[(4-AMINOPHENYL)METHYL]-, HYDROCHLORIDE
CAS No:916739-36-1
MF:C21H25ClN4
MW:368.903003454208
CID:996841
PubChem ID:57355795
Update Time:2025-04-20
BENZENEMETHANAMINE, 4-AMINO-N,N-BIS[(4-AMINOPHENYL)METHYL]-, HYDROCHLORIDE Chemical and Physical Properties
Names and Identifiers
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- BENZENEMETHANAMINE, 4-AMINO-N,N-BIS[(4-AMINOPHENYL)METHYL]-, HYDROCHLORIDE
- 4-[[bis[(4-aminophenyl)methyl]amino]methyl]aniline,hydrochloride
- 4-[[bis[(4-aminophenyl)methyl]amino]methyl]aniline;hydrochloride
- 4,4',4''-[Nitrilotris(methylene)]trianiline--hydrogen chloride (1/1)
- 916739-36-1
- DTXSID20723305
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- Inchi: 1S/C21H24N4.ClH/c22-19-7-1-16(2-8-19)13-25(14-17-3-9-20(23)10-4-17)15-18-5-11-21(24)12-6-18;/h1-12H,13-15,22-24H2;1H
- InChI Key: ASGGFCKRCFPYAQ-UHFFFAOYSA-N
- SMILES: Cl.N(CC1C=CC(=CC=1)N)(CC1C=CC(=CC=1)N)CC1C=CC(=CC=1)N
Computed Properties
- Exact Mass: 368.17700
- Monoisotopic Mass: 368.1767745g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 26
- Rotatable Bond Count: 6
- Complexity: 307
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 81.3?2
Experimental Properties
- PSA: 81.30000
- LogP: 6.18120
BENZENEMETHANAMINE, 4-AMINO-N,N-BIS[(4-AMINOPHENYL)METHYL]-, HYDROCHLORIDE Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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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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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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