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96679-53-7 | 4-phenyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine
CAS No: 96679-53-7 Catalog No: AG00IJUL MDL No:MFCD20663015
Product Description
Catalog Number:
AG00IJUL
Chemical Name:
4-phenyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine
CAS Number:
96679-53-7
Molecular Formula:
C13H13NO
Molecular Weight:
199.2484
MDL Number:
MFCD20663015
IUPAC Name:
4-phenyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine
InChI:
InChI=1S/C13H13NO/c1-2-4-10(5-3-1)13-11-7-9-15-12(11)6-8-14-13/h1-5,7,9,13-14H,6,8H2
InChI Key:
QLIPDLZNNHFNKM-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1NCCc2c1cco2
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.1g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.253g/mol
Monoisotopic Mass:
199.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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