Home Halogens 2-chloro-5,5,7,7-tetramethyl-5,7-dihydrofuro[3,4-b]pyridine-3-carbonitrile

2-chloro-5,5,7,7-tetramethyl-5,7-dihydrofuro[3,4-b]pyridine-3-carbonitrile

CAS No.:
1536198-21-6
Catalog Number:
AG01DVKA
Molecular Formula:
C12H13ClN2O
Molecular Weight:
236.6974
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Product Description
Catalog Number:
AG01DVKA
Chemical Name:
2-chloro-5,5,7,7-tetramethyl-5,7-dihydrofuro[3,4-b]pyridine-3-carbonitrile
CAS Number:
1536198-21-6
Molecular Formula:
C12H13ClN2O
Molecular Weight:
236.6974
MDL Number:
MFCD23795503
IUPAC Name:
2-chloro-5,5,7,7-tetramethylfuro[3,4-b]pyridine-3-carbonitrile
InChI:
InChI=1S/C12H13ClN2O/c1-11(2)8-5-7(6-14)10(13)15-9(8)12(3,4)16-11/h5H,1-4H3
InChI Key:
BJBPFHUCBBYMQO-UHFFFAOYSA-N
SMILES:
N#Cc1cc2c(nc1Cl)C(OC2(C)C)(C)C
Properties
Complexity:
344  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.072g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.699g/mol
Monoisotopic Mass:
236.072g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties