(3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanol

C16H17FO2 — CID 115823139

IUPAC(3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanol
SMILESCOc1cc(C(O)c2cc(C)cc(F)c2)ccc1C
InChIInChI=1S/C16H17FO2/c1-10-6-13(8-14(17)7-10)16(18)12-5-4-11(2)15(9-12)19-3/h4-9,16,18H,1-3H3
InChIKeyDSNYYAQYGZNHBO-UHFFFAOYSA-N
MW260.31 g/mol
LogP3.53
Rot. Bonds3

About (3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanol

(3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanol (PubChem CID 115823139) has the molecular formula C16H17FO2 and a molecular weight of 260.31 g/mol. Its IUPAC name is (3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanol.

Molecular Properties

Compound Name(3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanol
PubChem CID115823139
Molecular FormulaC16H17FO2
Molecular Weight260.31 g/mol
Exact Mass260.12
IUPAC Name(3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanol
SMILESCOc1cc(C(O)c2cc(C)cc(F)c2)ccc1C
InChIInChI=1S/C16H17FO2/c1-10-6-13(8-14(17)7-10)16(18)12-5-4-11(2)15(9-12)19-3/h4-9,16,18H,1-3H3
InChIKeyDSNYYAQYGZNHBO-UHFFFAOYSA-N
XLogP3.53
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3-fluoro-5-methylphenyl)-(4-methoxyphenyl)methanol
CID 79691470
(3-fluoro-5-methylphenyl)-(3-methoxyphenyl)methanol
CID 79689828
(3,4-dichlorophenyl)-(3-methoxy-4-methylphenyl)methanol
CID 61081399
(R)-(3,5-dimethylphenyl)-(4-fluorophenyl)methanol
CID 7154269
(3-chloro-4-methoxyphenyl)-(3,5-difluorophenyl)methanol
CID 61100009
(2-fluoro-3-methoxyphenyl)-(3-methoxy-4-methylphenyl)methanol
CID 115828621
(3-fluoro-5-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103433209
[4-(dimethylamino)phenyl]-(3-fluoro-5-methylphenyl)methanol
CID 79692029
(4-fluoro-3-methoxyphenyl)-(3-methylphenyl)methanol
CID 114977925
(3-methoxy-4-methylphenyl)-thiophen-3-ylmethanol
CID 115805659
(3,4-diethylphenyl)-(3-methoxy-4-methylphenyl)methanol
CID 115482617
(4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol
CID 115823109

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanol?
The IUPAC name of (3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanol (CID 115823139) is (3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanol.
What is the SMILES notation for (3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanol?
The canonical SMILES for (3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanol is COc1cc(C(O)c2cc(C)cc(F)c2)ccc1C.
What is the InChIKey of (3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanol?
The InChIKey is DSNYYAQYGZNHBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FO2/c1-10-6-13(8-14(17)7-10)16(18)12-5-4-11(2)15(9-12)19-3/h4-9,16,18H,1-3H3.
What are the key properties of (3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanol?
(3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanol has a molecular weight of 260.31 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanol is sourced from PubChem (CID 115823139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).