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1003707-32-1 | Quinoxaline, 5-(1-methylethyl)-
CAS No: 1003707-32-1 Catalog No: AG0001RC MDL No:
Product Description
Catalog Number:
AG0001RC
Chemical Name:
Quinoxaline, 5-(1-methylethyl)-
CAS Number:
1003707-32-1
Molecular Formula:
C11H12N2
Molecular Weight:
172.2264
IUPAC Name:
5-propan-2-ylquinoxaline
InChI:
InChI=1S/C11H12N2/c1-8(2)9-4-3-5-10-11(9)13-7-6-12-10/h3-8H,1-2H3
InChI Key:
RUNSAXLAQWVEMP-UHFFFAOYSA-N
SMILES:
CC(c1cccc2c1nccn2)C
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.1g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.231g/mol
Monoisotopic Mass:
172.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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