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72119-44-9 | 1(2H)-Quinoxalinecarboxaldehyde,3,4-dihydro-4-methyl-
CAS No: 72119-44-9 Catalog No: AG005K51 MDL No:MFCD21121419
Product Description
Catalog Number:
AG005K51
Chemical Name:
1(2H)-Quinoxalinecarboxaldehyde,3,4-dihydro-4-methyl-
CAS Number:
72119-44-9
Molecular Formula:
C10H12N2O
Molecular Weight:
176.2151
MDL Number:
MFCD21121419
IUPAC Name:
4-methyl-2,3-dihydroquinoxaline-1-carbaldehyde
InChI:
InChI=1S/C10H12N2O/c1-11-6-7-12(8-13)10-5-3-2-4-9(10)11/h2-5,8H,6-7H2,1H3
InChI Key:
HWLYSHFFLMBRLU-UHFFFAOYSA-N
SMILES:
O=CN1CCN(c2c1cccc2)C
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.219g/mol
Monoisotopic Mass:
176.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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