Home Halogens Methyl 2-(chloromethyl)nicotinate

Methyl 2-(chloromethyl)nicotinate

CAS No.:
177785-14-7
Catalog Number:
AG0025JG
Molecular Formula:
C8H8ClNO2
Molecular Weight:
185.6076
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Product Description
Catalog Number:
AG0025JG
Chemical Name:
Methyl 2-(chloromethyl)nicotinate
CAS Number:
177785-14-7
Molecular Formula:
C8H8ClNO2
Molecular Weight:
185.6076
MDL Number:
MFCD10699438
IUPAC Name:
methyl 2-(chloromethyl)pyridine-3-carboxylate
InChI:
InChI=1S/C8H8ClNO2/c1-12-8(11)6-3-2-4-10-7(6)5-9/h2-4H,5H2,1H3
InChI Key:
AMIVNKVBDFJAFD-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccnc1CCl
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:
1.1  
Properties