Home Halogens Methyl 4-(chloromethyl)pyridine-2-carboxylate

Methyl 4-(chloromethyl)pyridine-2-carboxylate

CAS No.:
1206973-14-9
Catalog Number:
AG00HFOO
Molecular Formula:
C8H8ClNO2
Molecular Weight:
185.6076
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Product Description
Catalog Number:
AG00HFOO
Chemical Name:
Methyl 4-(chloromethyl)pyridine-2-carboxylate
CAS Number:
1206973-14-9
Molecular Formula:
C8H8ClNO2
Molecular Weight:
185.6076
MDL Number:
MFCD18256215
IUPAC Name:
methyl 4-(chloromethyl)pyridine-2-carboxylate
InChI:
InChI=1S/C8H8ClNO2/c1-12-8(11)7-4-6(5-9)2-3-10-7/h2-4H,5H2,1H3
InChI Key:
UHRXRHOHZFCVDN-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(CCl)ccn1
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.024g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.607g/mol
Monoisotopic Mass:
185.024g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties