Home Halogens 4-(chloromethyl)-2-(2,3-dihydro-1-benzofuran-2-yl)pyrimidine

4-(chloromethyl)-2-(2,3-dihydro-1-benzofuran-2-yl)pyrimidine

CAS No.:
1558386-32-5
Catalog Number:
AG01BRT2
Molecular Formula:
C13H11ClN2O
Molecular Weight:
246.6922
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Product Description
Catalog Number:
AG01BRT2
Chemical Name:
4-(chloromethyl)-2-(2,3-dihydro-1-benzofuran-2-yl)pyrimidine
CAS Number:
1558386-32-5
Molecular Formula:
C13H11ClN2O
Molecular Weight:
246.6922
MDL Number:
MFCD25760554
IUPAC Name:
4-(chloromethyl)-2-(2,3-dihydro-1-benzofuran-2-yl)pyrimidine
InChI:
InChI=1S/C13H11ClN2O/c14-8-10-5-6-15-13(16-10)12-7-9-3-1-2-4-11(9)17-12/h1-6,12H,7-8H2
InChI Key:
QBEDYTZKPARYQG-UHFFFAOYSA-N
SMILES:
ClCc1ccnc(n1)C1Cc2c(O1)cccc2
Properties
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.056g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.694g/mol
Monoisotopic Mass:
246.056g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties