Cas no 17321-22-1 (Pyridazine, 3-butoxy-6-chloro-)
17321-22-1 structure
Product Name:Pyridazine, 3-butoxy-6-chloro-
CAS No:17321-22-1
MF:C8H11ClN2O
MW:186.638740777969
CID:236801
PubChem ID:252825
Update Time:2025-04-19
Pyridazine, 3-butoxy-6-chloro- Chemical and Physical Properties
Names and Identifiers
-
- Pyridazine, 3-butoxy-6-chloro-
- 3-butoxy-6-chloropyridazine
- 3-(n-butoxy)-6-chloropyridazine
- 3-butoxy-6-chloro-pyridazine
- 3-Butoxy-6-chlor-pyridazin
- 3-Chlor-6-butoxy-pyridazin
- 6-Butyloxy-3-chlor-pyridazin
- AC1L5MU4
- AC1Q3Q0Z
- AR-1F2363
- CTK0I4114
- NSC75068
- AKOS009409615
- TQP1663
- DTXSID10291361
- SCHEMBL6936975
- NSC-75068
- 17321-22-1
- NSC 75068
- JJJFYSURQUHJIQ-UHFFFAOYSA-N
-
- Inchi： 1S/C8H11ClN2O/c1-2-3-6-12-8-5-4-7(9)10-11-8/h4-5H,2-3,6H2,1H3
- InChI Key： JJJFYSURQUHJIQ-UHFFFAOYSA-N
- SMILES： ClC1=CC=C(N=N1)OCCCC
Computed Properties
- Exact Mass: 186.05613
- Monoisotopic Mass: 186.0559907g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 124
- 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: 2.1
- Topological Polar Surface Area: 35?2
Experimental Properties
- PSA: 35.01
- LogP: 2.30890
Pyridazine, 3-butoxy-6-chloro- Related Literature
-
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
-
Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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