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75987-20-1 | 4-(pyridin-3-ylmethyl)phenol
CAS No: 75987-20-1 Catalog No: AG01DWNJ MDL No:MFCD24714682
Product Description
Catalog Number:
AG01DWNJ
Chemical Name:
4-(pyridin-3-ylmethyl)phenol
CAS Number:
75987-20-1
Molecular Formula:
C12H11NO
Molecular Weight:
185.2218
MDL Number:
MFCD24714682
IUPAC Name:
4-(pyridin-3-ylmethyl)phenol
InChI:
InChI=1S/C12H11NO/c14-12-5-3-10(4-6-12)8-11-2-1-7-13-9-11/h1-7,9,14H,8H2
InChI Key:
ZUZPNKACINPWQR-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)Cc1cccnc1
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.084g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.226g/mol
Monoisotopic Mass:
185.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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