1,2-bis(ethenyl)-4-propylbenzene

C13H16 — CID 142025634

IUPAC1,2-bis(ethenyl)-4-propylbenzene
SMILESC=Cc1ccc(CCC)cc1C=C
InChIInChI=1S/C13H16/c1-4-7-11-8-9-12(5-2)13(6-3)10-11/h5-6,8-10H,2-4,7H2,1H3
InChIKeyKMDKJJHHEDAIPQ-UHFFFAOYSA-N
MW172.27 g/mol
LogP3.93
Rot. Bonds4

About 1,2-bis(ethenyl)-4-propylbenzene

1,2-bis(ethenyl)-4-propylbenzene (PubChem CID 142025634) has the molecular formula C13H16 and a molecular weight of 172.27 g/mol. Its IUPAC name is 1,2-bis(ethenyl)-4-propylbenzene.

Molecular Properties

Compound Name1,2-bis(ethenyl)-4-propylbenzene
PubChem CID142025634
Molecular FormulaC13H16
Molecular Weight172.27 g/mol
Exact Mass172.13
IUPAC Name1,2-bis(ethenyl)-4-propylbenzene
SMILESC=Cc1ccc(CCC)cc1C=C
InChIInChI=1S/C13H16/c1-4-7-11-8-9-12(5-2)13(6-3)10-11/h5-6,8-10H,2-4,7H2,1H3
InChIKeyKMDKJJHHEDAIPQ-UHFFFAOYSA-N
XLogP3.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-ethenyl-2,4-dipropylbenzene
CID 22033822
4-(2-butoxyethyl)-1,2-bis(ethenyl)benzene
CID 142240951
[3,4-bis(ethenyl)phenyl]methylphosphane
CID 166143558
1,4-dibutyl-2-ethenylbenzene
CID 140596757
1,2-bis(ethenyl)-4-(4-ethylphenyl)benzene
CID 156753876
ethane;2-ethenyl-4-(3-methylbut-3-enyl)-1-propylbenzene
CID 143112871
N-[2-(4-ethenyl-3-propylphenyl)ethyl]prop-1-en-2-amine
CID 134531448
1-ethenyl-4-iodo-2-propylbenzene
CID 141346319
3-ethenyl-2-propyl-1H-pyrrole
CID 143902050
ethane;1-ethenyl-4-ethyl-2-[(Z)-3-methylbut-1-enyl]benzene
CID 142526011
2-ethenyl-4-ethyl-1-pentan-3-ylbenzene
CID 123878875
1,2-bis(ethenyl)-4-ethoxybenzene
CID 142802318

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(ethenyl)-4-propylbenzene?
The IUPAC name of 1,2-bis(ethenyl)-4-propylbenzene (CID 142025634) is 1,2-bis(ethenyl)-4-propylbenzene.
What is the SMILES notation for 1,2-bis(ethenyl)-4-propylbenzene?
The canonical SMILES for 1,2-bis(ethenyl)-4-propylbenzene is C=Cc1ccc(CCC)cc1C=C.
What is the InChIKey of 1,2-bis(ethenyl)-4-propylbenzene?
The InChIKey is KMDKJJHHEDAIPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16/c1-4-7-11-8-9-12(5-2)13(6-3)10-11/h5-6,8-10H,2-4,7H2,1H3.
What are the key properties of 1,2-bis(ethenyl)-4-propylbenzene?
1,2-bis(ethenyl)-4-propylbenzene has a molecular weight of 172.27 g/mol, XLogP of 3.93, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(ethenyl)-4-propylbenzene is sourced from PubChem (CID 142025634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).