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936643-80-0 | 2-(Chloromethyl)pyrimidine hydrochloride
CAS No: 936643-80-0 Catalog No: AG003F0O MDL No:MFCD09834372
Product Description
Catalog Number:
AG003F0O
Chemical Name:
2-(Chloromethyl)pyrimidine hydrochloride
CAS Number:
936643-80-0
Molecular Formula:
C5H6Cl2N2
Molecular Weight:
165.0205
MDL Number:
MFCD09834372
IUPAC Name:
2-(chloromethyl)pyrimidine;hydrochloride
InChI:
InChI=1S/C5H5ClN2.ClH/c6-4-5-7-2-1-3-8-5;/h1-3H,4H2;1H
InChI Key:
XLGVMJXAZRCTRU-UHFFFAOYSA-N
SMILES:
ClCc1ncccn1.Cl
Properties
Complexity:
61.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.991g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
165.017g/mol
Monoisotopic Mass:
163.991g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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