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124959-28-0 | Pyrimidine, 2-chloro-4-(2-furanyl)-
CAS No: 124959-28-0 Catalog No: AG000MX8 MDL No:MFCD09065030
Product Description
Catalog Number:
AG000MX8
Chemical Name:
Pyrimidine, 2-chloro-4-(2-furanyl)-
CAS Number:
124959-28-0
Molecular Formula:
C8H5ClN2O
Molecular Weight:
180.5911
MDL Number:
MFCD09065030
IUPAC Name:
2-chloro-4-(furan-2-yl)pyrimidine
InChI:
InChI=1S/C8H5ClN2O/c9-8-10-4-3-6(11-8)7-2-1-5-12-7/h1-5H
InChI Key:
BLFCXYJTVFTNRX-UHFFFAOYSA-N
SMILES:
Clc1nccc(n1)c1ccco1
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.009g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.591g/mol
Monoisotopic Mass:
180.009g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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