1-fluoro-2-methylbenzene;formaldehyde

C8H9FO — CID 143723361

IUPAC1-fluoro-2-methylbenzene;formaldehyde
SMILESC=O.Cc1ccccc1F
InChIInChI=1S/C7H7F.CH2O/c1-6-4-2-3-5-7(6)8;1-2/h2-5H,1H3;1H2
InChIKeyAJYVLDLWTGRQCS-UHFFFAOYSA-N
MW140.16 g/mol
LogP1.95
Rot. Bonds

About 1-fluoro-2-methylbenzene;formaldehyde

1-fluoro-2-methylbenzene;formaldehyde (PubChem CID 143723361) has the molecular formula C8H9FO and a molecular weight of 140.16 g/mol. Its IUPAC name is 1-fluoro-2-methylbenzene;formaldehyde.

Molecular Properties

Compound Name1-fluoro-2-methylbenzene;formaldehyde
PubChem CID143723361
Molecular FormulaC8H9FO
Molecular Weight140.16 g/mol
Exact Mass140.06
IUPAC Name1-fluoro-2-methylbenzene;formaldehyde
SMILESC=O.Cc1ccccc1F
InChIInChI=1S/C7H7F.CH2O/c1-6-4-2-3-5-7(6)8;1-2/h2-5H,1H3;1H2
InChIKeyAJYVLDLWTGRQCS-UHFFFAOYSA-N
XLogP1.95
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.16
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

acetylene;1-fluoro-2-methylbenzene
CID 175248306
ethane;1-fluoro-2-methylbenzene;methane
CID 143320188
acetylene;ethane;1-fluoro-2-methylbenzene
CID 145259299
1-fluoro-2-methylbenzene;isocyanic acid
CID 175401975
ethane;1-fluoro-2-methylbenzene;propane
CID 143588585
1-fluoro-2-methylbenzene;phenol
CID 159985106
acetic acid;1-fluoro-2-methylbenzene;guanidine
CID 174681985
but-1-yne;1-fluoro-2-methylbenzene
CID 174807664
lithium;formaldehyde;hydride;bis(1,2-xylene)
CID 175061792
1-fluoro-2-methylbenzene;1-fluoro-3-methylbenzene;toluene
CID 160743052
1,3-difluoro-2-methylbenzene;ethane;1,2-xylene
CID 142353819
ethane;1-fluoro-4-methoxybenzene;1-fluoro-2-methylbenzene
CID 156880455

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-2-methylbenzene;formaldehyde?
The IUPAC name of 1-fluoro-2-methylbenzene;formaldehyde (CID 143723361) is 1-fluoro-2-methylbenzene;formaldehyde.
What is the SMILES notation for 1-fluoro-2-methylbenzene;formaldehyde?
The canonical SMILES for 1-fluoro-2-methylbenzene;formaldehyde is C=O.Cc1ccccc1F.
What is the InChIKey of 1-fluoro-2-methylbenzene;formaldehyde?
The InChIKey is AJYVLDLWTGRQCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F.CH2O/c1-6-4-2-3-5-7(6)8;1-2/h2-5H,1H3;1H2.
What are the key properties of 1-fluoro-2-methylbenzene;formaldehyde?
1-fluoro-2-methylbenzene;formaldehyde has a molecular weight of 140.16 g/mol, XLogP of 1.95, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-2-methylbenzene;formaldehyde is sourced from PubChem (CID 143723361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).