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253682-42-7 | 4,5,6,7-Tetrahydroisoxazolo[4,5-c]pyridine
CAS No: 253682-42-7 Catalog No: AG006V3Y MDL No:MFCD11042755
Product Description
Catalog Number:
AG006V3Y
Chemical Name:
4,5,6,7-Tetrahydroisoxazolo[4,5-c]pyridine
CAS Number:
253682-42-7
Molecular Formula:
C6H8N2O
Molecular Weight:
124.1405
MDL Number:
MFCD11042755
IUPAC Name:
4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-c]pyridine
InChI:
InChI=1S/C6H8N2O/c1-2-7-3-5-4-8-9-6(1)5/h4,7H,1-3H2
InChI Key:
YIGDNAMSWMGZNW-UHFFFAOYSA-N
SMILES:
C1NCc2c(C1)onc2
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.064g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
124.143g/mol
Monoisotopic Mass:
124.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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