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1188264-45-0

1188264-45-0 | 3-(4-Methoxyphenyl);-4,5,6,7-tetrahydroisoxazolo[4,5-c]pyridine

CAS No: 1188264-45-0 Catalog No: AG00HESB MDL No:

Product Description

Catalog Number:
AG00HESB
Chemical Name:
3-(4-Methoxyphenyl);-4,5,6,7-tetrahydroisoxazolo[4,5-c]pyridine
CAS Number:
1188264-45-0
Molecular Formula:
C13H14N2O2
Molecular Weight:
230.2625
IUPAC Name:
3-(4-methoxyphenyl)-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-c]pyridine
InChI:
InChI=1S/C13H14N2O2/c1-16-10-4-2-9(3-5-10)13-11-8-14-7-6-12(11)17-15-13/h2-5,14H,6-8H2,1H3
InChI Key:
VBGOCULLYKUKKQ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1noc2c1CNCC2

Properties

Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.106g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.267g/mol
Monoisotopic Mass:
230.106g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

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