2-methyl-1-(2-methylphenyl)cyclopropane-1-carboxylic acid

C12H14O2 — CID 83483787

IUPAC2-methyl-1-(2-methylphenyl)cyclopropane-1-carboxylic acid
SMILESCc1ccccc1C1(C(=O)O)CC1C
InChIInChI=1S/C12H14O2/c1-8-5-3-4-6-10(8)12(11(13)14)7-9(12)2/h3-6,9H,7H2,1-2H3,(H,13,14)
InChIKeyZLDKPZUBWSUVQB-UHFFFAOYSA-N
MW190.24 g/mol
LogP2.36
Rot. Bonds2

About 2-methyl-1-(2-methylphenyl)cyclopropane-1-carboxylic acid

2-methyl-1-(2-methylphenyl)cyclopropane-1-carboxylic acid (PubChem CID 83483787) has the molecular formula C12H14O2 and a molecular weight of 190.24 g/mol. Its IUPAC name is 2-methyl-1-(2-methylphenyl)cyclopropane-1-carboxylic acid.

Molecular Properties

Compound Name2-methyl-1-(2-methylphenyl)cyclopropane-1-carboxylic acid
PubChem CID83483787
Molecular FormulaC12H14O2
Molecular Weight190.24 g/mol
Exact Mass190.10
IUPAC Name2-methyl-1-(2-methylphenyl)cyclopropane-1-carboxylic acid
SMILESCc1ccccc1C1(C(=O)O)CC1C
InChIInChI=1S/C12H14O2/c1-8-5-3-4-6-10(8)12(11(13)14)7-9(12)2/h3-6,9H,7H2,1-2H3,(H,13,14)
InChIKeyZLDKPZUBWSUVQB-UHFFFAOYSA-N
XLogP2.36
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

methyl 2-methyl-1-(2-methylphenyl)cyclopropane-1-carboxylate
CID 116843020
1-(2-amino-3,5-dimethylphenyl)-2-methylcyclopropane-1-carboxylic acid
CID 106702438
3-(2-methylphenyl)bicyclo[1.1.1]pentane-1-carboxylic acid
CID 131697853
1-(2-methylphenyl)-3-propylcyclobutane-1-carboxylic acid
CID 65013569
1-hydroxy-2,4-dimethyl-2,3-dihydroindene-1-carboxylic acid
CID 112715912
1-(2-bromo-1-methylcyclopropyl)-2-methylbenzene
CID 102395819
4-(2-methylphenyl)oxane-4-carboxylic acid
CID 18524018
1-(2,5-dimethoxy-3,4-dimethylphenyl)-2-methylcyclopropane-1-carboxylic acid
CID 116842907
1-(3-bromophenyl)-2-methylcyclopropane-1-carboxylic acid
CID 83488510
2-(2-methylphenyl)spiro[3.6]decane-2-carboxylic acid
CID 65007655
1-(2-chlorophenyl)-2-propan-2-ylcyclopropane-1-carboxylic acid
CID 83842824
3-methyl-1-(2-methylphenyl)sulfanylcyclobutane-1-carboxylic acid
CID 66053230

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(2-methylphenyl)cyclopropane-1-carboxylic acid?
The IUPAC name of 2-methyl-1-(2-methylphenyl)cyclopropane-1-carboxylic acid (CID 83483787) is 2-methyl-1-(2-methylphenyl)cyclopropane-1-carboxylic acid.
What is the SMILES notation for 2-methyl-1-(2-methylphenyl)cyclopropane-1-carboxylic acid?
The canonical SMILES for 2-methyl-1-(2-methylphenyl)cyclopropane-1-carboxylic acid is Cc1ccccc1C1(C(=O)O)CC1C.
What is the InChIKey of 2-methyl-1-(2-methylphenyl)cyclopropane-1-carboxylic acid?
The InChIKey is ZLDKPZUBWSUVQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O2/c1-8-5-3-4-6-10(8)12(11(13)14)7-9(12)2/h3-6,9H,7H2,1-2H3,(H,13,14).
What are the key properties of 2-methyl-1-(2-methylphenyl)cyclopropane-1-carboxylic acid?
2-methyl-1-(2-methylphenyl)cyclopropane-1-carboxylic acid has a molecular weight of 190.24 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(2-methylphenyl)cyclopropane-1-carboxylic acid is sourced from PubChem (CID 83483787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).