Home Other Building Blocks 4-(pyrrolidin-3-yl)-1,2,3,4-tetrahydroquinoxalin-2-one hydrochloride

4-(pyrrolidin-3-yl)-1,2,3,4-tetrahydroquinoxalin-2-one hydrochloride

CAS No.:
1461714-27-1
Catalog Number:
AG01ABKJ
Molecular Formula:
C12H16ClN3O
Molecular Weight:
253.7279
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Product Description
Catalog Number:
AG01ABKJ
Chemical Name:
4-(pyrrolidin-3-yl)-1,2,3,4-tetrahydroquinoxalin-2-one hydrochloride
CAS Number:
1461714-27-1
Molecular Formula:
C12H16ClN3O
Molecular Weight:
253.7279
MDL Number:
MFCD25970526
IUPAC Name:
4-pyrrolidin-3-yl-1,3-dihydroquinoxalin-2-one;hydrochloride
InChI:
InChI=1S/C12H15N3O.ClH/c16-12-8-15(9-5-6-13-7-9)11-4-2-1-3-10(11)14-12;/h1-4,9,13H,5-8H2,(H,14,16);1H
InChI Key:
PMVUQHPTFWEKHC-UHFFFAOYSA-N
SMILES:
O=C1CN(C2CNCC2)c2c(N1)cccc2.Cl
Properties
Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.098g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
253.73g/mol
Monoisotopic Mass:
253.098g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties