1,5-dichloro-3-cyclopropyl-2-ethylbenzene

C11H12Cl2 — CID 123359975

IUPAC1,5-dichloro-3-cyclopropyl-2-ethylbenzene
SMILESCCc1c(Cl)cc(Cl)cc1C1CC1
InChIInChI=1S/C11H12Cl2/c1-2-9-10(7-3-4-7)5-8(12)6-11(9)13/h5-7H,2-4H2,1H3
InChIKeyBQDYVCCBUWNGRP-UHFFFAOYSA-N
MW215.12 g/mol
LogP4.43
Rot. Bonds2

About 1,5-dichloro-3-cyclopropyl-2-ethylbenzene

1,5-dichloro-3-cyclopropyl-2-ethylbenzene (PubChem CID 123359975) has the molecular formula C11H12Cl2 and a molecular weight of 215.12 g/mol. Its IUPAC name is 1,5-dichloro-3-cyclopropyl-2-ethylbenzene.

Molecular Properties

Compound Name1,5-dichloro-3-cyclopropyl-2-ethylbenzene
PubChem CID123359975
Molecular FormulaC11H12Cl2
Molecular Weight215.12 g/mol
Exact Mass214.03
IUPAC Name1,5-dichloro-3-cyclopropyl-2-ethylbenzene
SMILESCCc1c(Cl)cc(Cl)cc1C1CC1
InChIInChI=1S/C11H12Cl2/c1-2-9-10(7-3-4-7)5-8(12)6-11(9)13/h5-7H,2-4H2,1H3
InChIKeyBQDYVCCBUWNGRP-UHFFFAOYSA-N
XLogP4.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.12
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-ethyl-1,3,5-tris(4-methylcyclohexyl)benzene
CID 91362545
2-chloro-1-cyclopropyl-4-ethylbenzene
CID 138612116
4-cyclopropyl-5-ethyl-6-methylpyridin-2-amine
CID 118491476
3-(5-chloro-2-ethyl-3-methoxyphenyl)piperidine
CID 117387978
1-chloro-4-cyclopropyl-2-(difluoromethoxy)-5-ethylbenzene
CID 177001288
2-chloro-1-cyclopropyl-4-methylbenzene;ethane
CID 144845511
1-(2,4-dichloro-6-methylphenyl)-N-methylmethanamine
CID 18721638
4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine
CID 117387972
4-(5-chloro-2-methylphenyl)cyclohexan-1-ol
CID 161121388
6,8-dichloro-N-(2-methylpentan-3-yl)-3,4-dihydro-2H-chromen-4-amine
CID 63456363
2-[(6,8-dichloro-3,4-dihydro-2H-chromen-4-yl)amino]-2-ethylpropane-1,3-diol
CID 103935764
5-chloro-4-cyclopropyl-2-methylpyridine
CID 172907560

Frequently Asked Questions

What is the IUPAC name of 1,5-dichloro-3-cyclopropyl-2-ethylbenzene?
The IUPAC name of 1,5-dichloro-3-cyclopropyl-2-ethylbenzene (CID 123359975) is 1,5-dichloro-3-cyclopropyl-2-ethylbenzene.
What is the SMILES notation for 1,5-dichloro-3-cyclopropyl-2-ethylbenzene?
The canonical SMILES for 1,5-dichloro-3-cyclopropyl-2-ethylbenzene is CCc1c(Cl)cc(Cl)cc1C1CC1.
What is the InChIKey of 1,5-dichloro-3-cyclopropyl-2-ethylbenzene?
The InChIKey is BQDYVCCBUWNGRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12Cl2/c1-2-9-10(7-3-4-7)5-8(12)6-11(9)13/h5-7H,2-4H2,1H3.
What are the key properties of 1,5-dichloro-3-cyclopropyl-2-ethylbenzene?
1,5-dichloro-3-cyclopropyl-2-ethylbenzene has a molecular weight of 215.12 g/mol, XLogP of 4.43, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dichloro-3-cyclopropyl-2-ethylbenzene is sourced from PubChem (CID 123359975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).