Cas no 400877-18-1 ((1-(2-Chlorophenyl)-1H-pyrazol-4-yl)methanamine)
400877-18-1 structure
Product Name:(1-(2-Chlorophenyl)-1H-pyrazol-4-yl)methanamine
CAS No:400877-18-1
MF:C10H10ClN3
MW:207.659500598907
CID:925280
PubChem ID:43381494
Update Time:2025-04-19
(1-(2-Chlorophenyl)-1H-pyrazol-4-yl)methanamine Chemical and Physical Properties
Names and Identifiers
-
- (1-(2-Chlorophenyl)-1H-pyrazol-4-yl)methanamine
- 400877-18-1
- [1-(2-chlorophenyl)pyrazol-4-yl]methanamine
- AM20040398
-
- Inchi： 1S/C10H10ClN3/c11-9-3-1-2-4-10(9)14-7-8(5-12)6-13-14/h1-4,6-7H,5,12H2
- InChI Key： CIQKNQJFUKLJMR-UHFFFAOYSA-N
- SMILES： ClC1C=CC=CC=1N1C=C(C=N1)CN
Computed Properties
- Exact Mass: 207.0563250g/mol
- Monoisotopic Mass: 207.0563250g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 188
- 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: 43.8?2
(1-(2-Chlorophenyl)-1H-pyrazol-4-yl)methanamine Related Literature
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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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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