Home Nitriles 3-iodo-4-(methoxymethoxy)benzonitrile

3-iodo-4-(methoxymethoxy)benzonitrile

CAS No.:
1332591-18-0
Catalog Number:
AG01BHLB
Molecular Formula:
C9H8INO2
Molecular Weight:
289.0698
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Product Description
Catalog Number:
AG01BHLB
Chemical Name:
3-iodo-4-(methoxymethoxy)benzonitrile
CAS Number:
1332591-18-0
Molecular Formula:
C9H8INO2
Molecular Weight:
289.0698
MDL Number:
MFCD20268163
IUPAC Name:
3-iodo-4-(methoxymethoxy)benzonitrile
InChI:
InChI=1S/C9H8INO2/c1-12-6-13-9-3-2-7(5-11)4-8(9)10/h2-4H,6H2,1H3
InChI Key:
SCWQQCHMCBMDLN-UHFFFAOYSA-N
SMILES:
COCOc1ccc(cc1I)C#N
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.96g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.072g/mol
Monoisotopic Mass:
288.96g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties