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889939-79-1 | (4-(4-Fluorophenyl);tetrahydro-2H-pyran-4-yl);methanamine
CAS No: 889939-79-1 Catalog No: AG00440F MDL No:MFCD08144102
Product Description
Catalog Number:
AG00440F
Chemical Name:
(4-(4-Fluorophenyl);tetrahydro-2H-pyran-4-yl);methanamine
CAS Number:
889939-79-1
Molecular Formula:
C12H16FNO
Molecular Weight:
209.2599
MDL Number:
MFCD08144102
IUPAC Name:
[4-(4-fluorophenyl)oxan-4-yl]methanamine
InChI:
InChI=1S/C12H16FNO/c13-11-3-1-10(2-4-11)12(9-14)5-7-15-8-6-12/h1-4H,5-9,14H2
InChI Key:
RJNKDRCJNIVDII-UHFFFAOYSA-N
SMILES:
NCC1(CCOCC1)c1ccc(cc1)F
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.122g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.264g/mol
Monoisotopic Mass:
209.122g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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