Cas no 872266-55-2 ( )
structure
Product Name:
CAS No:872266-55-2
MF:C9H17N3
MW:167.251381635666
CID:874843
PubChem ID:34176685
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- 5‐AMINO‐3‐HEXYL‐PYRAZOLE
- 5-Hexyl-1H-pyrazol-3-amine
- EN300-1147585
- 872266-55-2
- AKOS006310712
- 3-Hexyl-1H-pyrazol-5-amine
- DTXSID80652985
- SCHEMBL19973201
- SCHEMBL8512535
-
-
- Inchi： 1S/C9H17N3/c1-2-3-4-5-6-8-7-9(10)12-11-8/h7H,2-6H2,1H3,(H3,10,11,12)
- InChI Key： HLHGRAKVEQLSNX-UHFFFAOYSA-N
- SMILES： N1C(=CC(N)=N1)CCCCCC
Computed Properties
- Exact Mass: 167.142247555g/mol
- Monoisotopic Mass: 167.142247555g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 5
- Complexity: 116
- 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: 2.7
- Topological Polar Surface Area: 54.7?2
Related Literature
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
-
Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
-
Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
-
Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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