Home Halogens 2H-1-Benzopyran-2-one, 7-amino-4-(chloromethyl)-

2H-1-Benzopyran-2-one, 7-amino-4-(chloromethyl)-

CAS No.:
147963-22-2
Catalog Number:
AG001FC0
Molecular Formula:
C10H8ClNO2
Molecular Weight:
209.6290
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Product Description
Catalog Number:
AG001FC0
Chemical Name:
2H-1-Benzopyran-2-one, 7-amino-4-(chloromethyl)-
CAS Number:
147963-22-2
Molecular Formula:
C10H8ClNO2
Molecular Weight:
209.6290
MDL Number:
MFCD00467167
IUPAC Name:
7-amino-4-(chloromethyl)chromen-2-one
InChI:
InChI=1S/C10H8ClNO2/c11-5-6-3-10(13)14-9-4-7(12)1-2-8(6)9/h1-4H,5,12H2
InChI Key:
VIEYMVWPECAOCY-UHFFFAOYSA-N
SMILES:
ClCc1cc(=O)oc2c1ccc(c2)N
Properties
Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.024g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
209.629g/mol
Monoisotopic Mass:
209.024g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
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Properties