7,8a-dimethyl-2,8-dihydro-1H-naphthalene

C12H16 — CID 143658641

IUPAC7,8a-dimethyl-2,8-dihydro-1H-naphthalene
SMILESCC1=CC=C2C=CCCC2(C)C1
InChIInChI=1S/C12H16/c1-10-6-7-11-5-3-4-8-12(11,2)9-10/h3,5-7H,4,8-9H2,1-2H3
InChIKeyJSRFXWYCWIROSA-UHFFFAOYSA-N
MW160.26 g/mol
LogP3.62
Rot. Bonds

About 7,8a-dimethyl-2,8-dihydro-1H-naphthalene

7,8a-dimethyl-2,8-dihydro-1H-naphthalene (PubChem CID 143658641) has the molecular formula C12H16 and a molecular weight of 160.26 g/mol. Its IUPAC name is 7,8a-dimethyl-2,8-dihydro-1H-naphthalene.

Molecular Properties

Compound Name7,8a-dimethyl-2,8-dihydro-1H-naphthalene
PubChem CID143658641
Molecular FormulaC12H16
Molecular Weight160.26 g/mol
Exact Mass160.13
IUPAC Name7,8a-dimethyl-2,8-dihydro-1H-naphthalene
SMILESCC1=CC=C2C=CCCC2(C)C1
InChIInChI=1S/C12H16/c1-10-6-7-11-5-3-4-8-12(11,2)9-10/h3,5-7H,4,8-9H2,1-2H3
InChIKeyJSRFXWYCWIROSA-UHFFFAOYSA-N
XLogP3.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.26
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(4aR)-4a-methyl-3,4,5,6-tetrahydronaphthalen-2-one
CID 14143533
(8aS)-4,8a-dimethyl-2,3,7,8-tetrahydro-1H-naphthalene
CID 163043079
2-[(4aS)-4a-methyl-3,4,5,6-tetrahydro-2H-naphthalen-2-yl]propan-2-ol
CID 70887557
4,4a-dimethyl-3,4,5,6-tetrahydronaphthalen-2-one
CID 12920740
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CID 143563701
6-methyl-6-prop-2-enylcyclohex-2-en-1-one
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(7R,8R,9S,10R,13S,14S)-7-hydroxy-10,13-dimethyl-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-one
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[(4,6,6-trimethylcyclohexa-1,3-dien-1-yl)methylideneamino]urea
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2,5-dimethylbicyclo[3.1.0]hex-1-ene
CID 91551735
(5Z,7Z)-3,3,5-trimethyl-4,9-dihydro-2H-oxonine
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Frequently Asked Questions

What is the IUPAC name of 7,8a-dimethyl-2,8-dihydro-1H-naphthalene?
The IUPAC name of 7,8a-dimethyl-2,8-dihydro-1H-naphthalene (CID 143658641) is 7,8a-dimethyl-2,8-dihydro-1H-naphthalene.
What is the SMILES notation for 7,8a-dimethyl-2,8-dihydro-1H-naphthalene?
The canonical SMILES for 7,8a-dimethyl-2,8-dihydro-1H-naphthalene is CC1=CC=C2C=CCCC2(C)C1.
What is the InChIKey of 7,8a-dimethyl-2,8-dihydro-1H-naphthalene?
The InChIKey is JSRFXWYCWIROSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16/c1-10-6-7-11-5-3-4-8-12(11,2)9-10/h3,5-7H,4,8-9H2,1-2H3.
What are the key properties of 7,8a-dimethyl-2,8-dihydro-1H-naphthalene?
7,8a-dimethyl-2,8-dihydro-1H-naphthalene has a molecular weight of 160.26 g/mol, XLogP of 3.62, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8a-dimethyl-2,8-dihydro-1H-naphthalene is sourced from PubChem (CID 143658641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).