2-chloro-1-(2-chloroprop-1-enoxy)prop-1-ene

C6H8Cl2O — CID 140516361

IUPAC2-chloro-1-(2-chloroprop-1-enoxy)prop-1-ene
SMILESCC(Cl)=COC=C(C)Cl
InChIInChI=1S/C6H8Cl2O/c1-5(7)3-9-4-6(2)8/h3-4H,1-2H3
InChIKeyHFPAISQJRASSLA-UHFFFAOYSA-N
MW167.03 g/mol
LogP3.20
Rot. Bonds2

About 2-chloro-1-(2-chloroprop-1-enoxy)prop-1-ene

2-chloro-1-(2-chloroprop-1-enoxy)prop-1-ene (PubChem CID 140516361) has the molecular formula C6H8Cl2O and a molecular weight of 167.03 g/mol. Its IUPAC name is 2-chloro-1-(2-chloroprop-1-enoxy)prop-1-ene.

Molecular Properties

Compound Name2-chloro-1-(2-chloroprop-1-enoxy)prop-1-ene
PubChem CID140516361
Molecular FormulaC6H8Cl2O
Molecular Weight167.03 g/mol
Exact Mass166.00
IUPAC Name2-chloro-1-(2-chloroprop-1-enoxy)prop-1-ene
SMILESCC(Cl)=COC=C(C)Cl
InChIInChI=1S/C6H8Cl2O/c1-5(7)3-9-4-6(2)8/h3-4H,1-2H3
InChIKeyHFPAISQJRASSLA-UHFFFAOYSA-N
XLogP3.20
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.03
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

CID 136818460
CID 136818460
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(E)-3-chloro-1-fluorobut-2-ene
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2-chloroprop-1-en-1-amine
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(E)-2-chloroprop-1-ene-1-thiol
CID 143576946
(Z)-2-chloro-1-fluoroprop-1-en-1-ol
CID 173270736
2-(2-chloroprop-1-enoxyimino)acetic acid
CID 71411487
hypochlorous acid;ruthenium
CID 173006590
(E)-2-chlorohex-2-ene
CID 19796923
(E)-4-chloro-1-dichlorophosphoryl-2-methylbut-2-ene
CID 12540868
(E)-3-chloro-1-(2-methylpropoxy)but-2-ene
CID 169180662
(2E,4E)-2-chloro-5-methoxyhexa-2,4-diene
CID 122521311

Frequently Asked Questions

What is the IUPAC name of 2-chloro-1-(2-chloroprop-1-enoxy)prop-1-ene?
The IUPAC name of 2-chloro-1-(2-chloroprop-1-enoxy)prop-1-ene (CID 140516361) is 2-chloro-1-(2-chloroprop-1-enoxy)prop-1-ene.
What is the SMILES notation for 2-chloro-1-(2-chloroprop-1-enoxy)prop-1-ene?
The canonical SMILES for 2-chloro-1-(2-chloroprop-1-enoxy)prop-1-ene is CC(Cl)=COC=C(C)Cl.
What is the InChIKey of 2-chloro-1-(2-chloroprop-1-enoxy)prop-1-ene?
The InChIKey is HFPAISQJRASSLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8Cl2O/c1-5(7)3-9-4-6(2)8/h3-4H,1-2H3.
What are the key properties of 2-chloro-1-(2-chloroprop-1-enoxy)prop-1-ene?
2-chloro-1-(2-chloroprop-1-enoxy)prop-1-ene has a molecular weight of 167.03 g/mol, XLogP of 3.20, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-1-(2-chloroprop-1-enoxy)prop-1-ene is sourced from PubChem (CID 140516361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).