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885271-24-9

885271-24-9 | 6-Bromo-8-methoxy-2H-chromene-3-carbonitrile

CAS No: 885271-24-9 Catalog No: AG00473P MDL No:MFCD04114598

Product Description

Catalog Number:
AG00473P
Chemical Name:
6-Bromo-8-methoxy-2H-chromene-3-carbonitrile
CAS Number:
885271-24-9
Molecular Formula:
C11H8BrNO2
Molecular Weight:
266.0907
MDL Number:
MFCD04114598
IUPAC Name:
6-bromo-8-methoxy-2H-chromene-3-carbonitrile
InChI:
InChI=1S/C11H8BrNO2/c1-14-10-4-9(12)3-8-2-7(5-13)6-15-11(8)10/h2-4H,6H2,1H3
InChI Key:
DEZLOCCCPMXTEQ-UHFFFAOYSA-N
SMILES:
N#CC1=Cc2c(OC1)c(OC)cc(c2)Br

Properties

Complexity:
320  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.974g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.094g/mol
Monoisotopic Mass:
264.974g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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