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799270-80-7

799270-80-7 | Pyrimidine, 2-chloro-5-methoxy-4-(1E)-1-nonenyl-

CAS No: 799270-80-7 Catalog No: AG005F6E MDL No:

Product Description

Catalog Number:
AG005F6E
Chemical Name:
Pyrimidine, 2-chloro-5-methoxy-4-(1E)-1-nonenyl-
CAS Number:
799270-80-7
Molecular Formula:
C14H21ClN2O
Molecular Weight:
268.7823
IUPAC Name:
2-chloro-5-methoxy-4-non-1-enylpyrimidine
InChI:
InChI=1S/C14H21ClN2O/c1-3-4-5-6-7-8-9-10-12-13(18-2)11-16-14(15)17-12/h9-11H,3-8H2,1-2H3
InChI Key:
ATDSJTVENHYOBU-UHFFFAOYSA-N
SMILES:
CCCCCCC/C=C/c1nc(Cl)ncc1OC

Properties

Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.134g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.785g/mol
Monoisotopic Mass:
268.134g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
5.3  

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