2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]prop-1-ene

C11H21ClO4 — CID 139925927

IUPAC2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]prop-1-ene
SMILESC=C(C)OCCOCCOCCOCCCl
InChIInChI=1S/C11H21ClO4/c1-11(2)16-10-9-15-8-7-14-6-5-13-4-3-12/h1,3-10H2,2H3
InChIKeyDLLXPWOIUCOGRN-UHFFFAOYSA-N
MW252.74 g/mol
LogP1.83
Rot. Bonds12

About 2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]prop-1-ene

2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]prop-1-ene (PubChem CID 139925927) has the molecular formula C11H21ClO4 and a molecular weight of 252.74 g/mol. Its IUPAC name is 2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]prop-1-ene.

Molecular Properties

Compound Name2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]prop-1-ene
PubChem CID139925927
Molecular FormulaC11H21ClO4
Molecular Weight252.74 g/mol
Exact Mass252.11
IUPAC Name2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]prop-1-ene
SMILESC=C(C)OCCOCCOCCOCCCl
InChIInChI=1S/C11H21ClO4/c1-11(2)16-10-9-15-8-7-14-6-5-13-4-3-12/h1,3-10H2,2H3
InChIKeyDLLXPWOIUCOGRN-UHFFFAOYSA-N
XLogP1.83
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.74
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-prop-1-en-2-yloxyethoxy)ethanol
CID 87206577
2-[2-[2-[2-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]prop-1-ene
CID 175050176
2-[2-[2-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]prop-1-ene
CID 139925917
2-(2-prop-1-en-2-yloxyethoxy)ethyl acetate
CID 161380709
2-[2-(2-prop-1-en-2-yloxyethoxy)ethoxy]ethyl prop-2-enoate
CID 141287577
2-(2-chloroethoxy)ethyl propanoate
CID 5092973
2-(2-chloroethoxy)ethyl methyl carbonate
CID 103970602
2-(2-chloroethoxy)ethyl N-methylcarbamate
CID 103970595
1-chloro-2-(2-chloroethoxy)ethane;dichloromethane
CID 174956973
1,3-bis(prop-1-en-2-yloxy)propane;methane
CID 162270596
2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
CID 7979
2-[2-[2-[2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
CID 18762112

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]prop-1-ene?
The IUPAC name of 2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]prop-1-ene (CID 139925927) is 2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]prop-1-ene.
What is the SMILES notation for 2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]prop-1-ene?
The canonical SMILES for 2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]prop-1-ene is C=C(C)OCCOCCOCCOCCCl.
What is the InChIKey of 2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]prop-1-ene?
The InChIKey is DLLXPWOIUCOGRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21ClO4/c1-11(2)16-10-9-15-8-7-14-6-5-13-4-3-12/h1,3-10H2,2H3.
What are the key properties of 2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]prop-1-ene?
2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]prop-1-ene has a molecular weight of 252.74 g/mol, XLogP of 1.83, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]prop-1-ene is sourced from PubChem (CID 139925927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).