1,2-dimethyl-6-(3-methylphenyl)naphthalene

C19H18 — CID 58239617

IUPAC1,2-dimethyl-6-(3-methylphenyl)naphthalene
SMILESCc1cccc(-c2ccc3c(C)c(C)ccc3c2)c1
InChIInChI=1S/C19H18/c1-13-5-4-6-16(11-13)17-9-10-19-15(3)14(2)7-8-18(19)12-17/h4-12H,1-3H3
InChIKeyKCWPTTBUWKCBCX-UHFFFAOYSA-N
MW246.35 g/mol
LogP5.43
Rot. Bonds1

About 1,2-dimethyl-6-(3-methylphenyl)naphthalene

1,2-dimethyl-6-(3-methylphenyl)naphthalene (PubChem CID 58239617) has the molecular formula C19H18 and a molecular weight of 246.35 g/mol. Its IUPAC name is 1,2-dimethyl-6-(3-methylphenyl)naphthalene.

Molecular Properties

Compound Name1,2-dimethyl-6-(3-methylphenyl)naphthalene
PubChem CID58239617
Molecular FormulaC19H18
Molecular Weight246.35 g/mol
Exact Mass246.14
IUPAC Name1,2-dimethyl-6-(3-methylphenyl)naphthalene
SMILESCc1cccc(-c2ccc3c(C)c(C)ccc3c2)c1
InChIInChI=1S/C19H18/c1-13-5-4-6-16(11-13)17-9-10-19-15(3)14(2)7-8-18(19)12-17/h4-12H,1-3H3
InChIKeyKCWPTTBUWKCBCX-UHFFFAOYSA-N
XLogP5.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500246.35
LogP ≤ 55.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4-methyl-7-(3-methylphenyl)naphthalen-2-amine
CID 167271661
1,2-bis(2-methylphenyl)benzene;1,2-bis(3-methylphenyl)benzene;1,4-bis(2-methylphenyl)benzene;1,4-bis(4-methylphenyl)benzene;1,2-dimethylnaphthalene;1,3-dimethylnaphthalene;1,5-dimethylnaphthalene;1,6-dimethylnaphthalene;1,7-dimethylnaphthalene;1-methyl-2-[2-(3-methylphenyl)phenyl]benzene;1-methyl-2-[4-(4-methylphenyl)phenyl]benzene
CID 157445243
9-(3-methylphenyl)-2,7-bis(4-methylphenyl)anthracene
CID 142700276
1-methyl-6-(7-methylnaphthalen-2-yl)naphthalene
CID 143742447
1,2,3,4-tetramethylbenzene;bis(1,2,3,5-tetramethylbenzene);1,2,5,6-tetramethylnaphthalene;bis(1,2,4-trimethylbenzene);bis(1,2,6-trimethylnaphthalene)
CID 158674501
9-(3-methylphenyl)-2,7-diphenylanthracene
CID 142700269
bis(1,2,4-trimethylbenzene);bis(1,2,4-trimethylnaphthalene);bis(1,2,6-trimethylnaphthalene)
CID 161343592
2-methyl-6-[3-(6-methylnaphthalen-2-yl)phenyl]naphthalene
CID 58943209
ethane;2-(3-methylphenyl)triphenylene
CID 90881937
methane;1-methyl-3-(4-methylphenyl)benzene
CID 158328523
1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene
CID 58879503
1-methyl-3-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene
CID 58892418

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-6-(3-methylphenyl)naphthalene?
The IUPAC name of 1,2-dimethyl-6-(3-methylphenyl)naphthalene (CID 58239617) is 1,2-dimethyl-6-(3-methylphenyl)naphthalene.
What is the SMILES notation for 1,2-dimethyl-6-(3-methylphenyl)naphthalene?
The canonical SMILES for 1,2-dimethyl-6-(3-methylphenyl)naphthalene is Cc1cccc(-c2ccc3c(C)c(C)ccc3c2)c1.
What is the InChIKey of 1,2-dimethyl-6-(3-methylphenyl)naphthalene?
The InChIKey is KCWPTTBUWKCBCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18/c1-13-5-4-6-16(11-13)17-9-10-19-15(3)14(2)7-8-18(19)12-17/h4-12H,1-3H3.
What are the key properties of 1,2-dimethyl-6-(3-methylphenyl)naphthalene?
1,2-dimethyl-6-(3-methylphenyl)naphthalene has a molecular weight of 246.35 g/mol, XLogP of 5.43, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-6-(3-methylphenyl)naphthalene is sourced from PubChem (CID 58239617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).