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1407532-87-9 | 3-iodo-5-methyl-1,2-dihydro-1,6-naphthyridin-2-one
CAS No: 1407532-87-9 Catalog No: AG00IUXC MDL No:MFCD22573530
Product Description
Catalog Number:
AG00IUXC
Chemical Name:
3-iodo-5-methyl-1,2-dihydro-1,6-naphthyridin-2-one
CAS Number:
1407532-87-9
Molecular Formula:
C9H7IN2O
Molecular Weight:
286.0691
MDL Number:
MFCD22573530
IUPAC Name:
3-iodo-5-methyl-1H-1,6-naphthyridin-2-one
InChI:
InChI=1S/C9H7IN2O/c1-5-6-4-7(10)9(13)12-8(6)2-3-11-5/h2-4H,1H3,(H,12,13)
InChI Key:
ZDGRMUYBFGNPMI-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2ccnc(c2cc1I)C
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.96g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.072g/mol
Monoisotopic Mass:
285.96g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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