Cas no 122957-34-0 (Benzonitrile, 4-[(3-amino-4-pyridinyl)amino]-)
122957-34-0 structure
Product Name:Benzonitrile, 4-[(3-amino-4-pyridinyl)amino]-
CAS No:122957-34-0
MF:C12H10N4
MW:210.23460149765
CID:1214987
PubChem ID:10536420
Update Time:2025-04-20
Benzonitrile, 4-[(3-amino-4-pyridinyl)amino]- Chemical and Physical Properties
Names and Identifiers
-
- Benzonitrile, 4-[(3-amino-4-pyridinyl)amino]-
- 3-amino-4-[N-(4-cyanophenyl)amino]pyridine
- 4-[(3-amino-4-pyridinyl)amino]Benzonitrile
- DA-21851
- SCHEMBL7497750
- YUSNIYMLRWTCCC-UHFFFAOYSA-N
- 3-Amino-4-(4'-cyanophenyl)aminopyridine
- 122957-34-0
-
- Inchi: 1S/C12H10N4/c13-7-9-1-3-10(4-2-9)16-12-5-6-15-8-11(12)14/h1-6,8H,14H2,(H,15,16)
- InChI Key: YUSNIYMLRWTCCC-UHFFFAOYSA-N
- SMILES: N(C1C=CC(C#N)=CC=1)C1C=CN=CC=1N
Computed Properties
- Exact Mass: 210.090546336g/mol
- Monoisotopic Mass: 210.090546336g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 261
- 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: 1.4
- Topological Polar Surface Area: 74.7?2
Benzonitrile, 4-[(3-amino-4-pyridinyl)amino]- Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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