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Home > Pyridines > 1373232-37-1
1373232-37-1 | Pyridine, 3-[4-(1,1-dimethylethyl)phenyl]-5-methoxy-
CAS No: 1373232-37-1 Catalog No: AG00134S MDL No:MFCD22192491
Product Description
Catalog Number:
AG00134S
Chemical Name:
Pyridine, 3-[4-(1,1-dimethylethyl)phenyl]-5-methoxy-
CAS Number:
1373232-37-1
Molecular Formula:
C16H19NO
Molecular Weight:
241.3282
MDL Number:
MFCD22192491
IUPAC Name:
3-(4-tert-butylphenyl)-5-methoxypyridine
InChI:
InChI=1S/C16H19NO/c1-16(2,3)14-7-5-12(6-8-14)13-9-15(18-4)11-17-10-13/h5-11H,1-4H3
InChI Key:
DDEIYPWNXNQMMN-UHFFFAOYSA-N
SMILES:
COc1cncc(c1)c1ccc(cc1)C(C)(C)C
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.147g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.334g/mol
Monoisotopic Mass:
241.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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