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90684-19-8 | Phenol, 2-methoxy-4-(1,2,3,6-tetrahydro-4-pyridinyl)-
CAS No: 90684-19-8 Catalog No: AG006NAU MDL No:
Product Description
Catalog Number:
AG006NAU
Chemical Name:
Phenol, 2-methoxy-4-(1,2,3,6-tetrahydro-4-pyridinyl)-
CAS Number:
90684-19-8
Molecular Formula:
C12H15NO2
Molecular Weight:
205.2530
IUPAC Name:
2-methoxy-4-(1,2,3,6-tetrahydropyridin-4-yl)phenol
InChI:
InChI=1S/C12H15NO2/c1-15-12-8-10(2-3-11(12)14)9-4-6-13-7-5-9/h2-4,8,13-14H,5-7H2,1H3
InChI Key:
WWAKCFYJVOQDNY-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1O)C1=CCNCC1
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.11g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
205.257g/mol
Monoisotopic Mass:
205.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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