1-hexa-3,4-dien-2-yl-2-methylcyclopropane

C10H16 — CID 123495353

IUPAC1-hexa-3,4-dien-2-yl-2-methylcyclopropane
SMILESCC=C=CC(C)C1CC1C
InChIInChI=1S/C10H16/c1-4-5-6-8(2)10-7-9(10)3/h4,6,8-10H,7H2,1-3H3
InChIKeyWBJOYXRKJRTGID-UHFFFAOYSA-N
MW136.24 g/mol
LogP3.01
Rot. Bonds2

About 1-hexa-3,4-dien-2-yl-2-methylcyclopropane

1-hexa-3,4-dien-2-yl-2-methylcyclopropane (PubChem CID 123495353) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is 1-hexa-3,4-dien-2-yl-2-methylcyclopropane.

Molecular Properties

Compound Name1-hexa-3,4-dien-2-yl-2-methylcyclopropane
PubChem CID123495353
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name1-hexa-3,4-dien-2-yl-2-methylcyclopropane
SMILESCC=C=CC(C)C1CC1C
InChIInChI=1S/C10H16/c1-4-5-6-8(2)10-7-9(10)3/h4,6,8-10H,7H2,1-3H3
InChIKeyWBJOYXRKJRTGID-UHFFFAOYSA-N
XLogP3.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-hexa-3,4-dien-2-yl-2-methylcyclopropane?
The IUPAC name of 1-hexa-3,4-dien-2-yl-2-methylcyclopropane (CID 123495353) is 1-hexa-3,4-dien-2-yl-2-methylcyclopropane.
What is the SMILES notation for 1-hexa-3,4-dien-2-yl-2-methylcyclopropane?
The canonical SMILES for 1-hexa-3,4-dien-2-yl-2-methylcyclopropane is CC=C=CC(C)C1CC1C.
What is the InChIKey of 1-hexa-3,4-dien-2-yl-2-methylcyclopropane?
The InChIKey is WBJOYXRKJRTGID-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16/c1-4-5-6-8(2)10-7-9(10)3/h4,6,8-10H,7H2,1-3H3.
What are the key properties of 1-hexa-3,4-dien-2-yl-2-methylcyclopropane?
1-hexa-3,4-dien-2-yl-2-methylcyclopropane has a molecular weight of 136.24 g/mol, XLogP of 3.01, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hexa-3,4-dien-2-yl-2-methylcyclopropane is sourced from PubChem (CID 123495353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).