2-chlorohex-2-en-1-ol

C6H11ClO — CID 130125414

IUPAC2-chlorohex-2-en-1-ol
SMILESCCCC=C(Cl)CO
InChIInChI=1S/C6H11ClO/c1-2-3-4-6(7)5-8/h4,8H,2-3,5H2,1H3
InChIKeyMZZQWZRZHJVAAB-UHFFFAOYSA-N
MW134.61 g/mol
LogP1.90
Rot. Bonds3

About 2-chlorohex-2-en-1-ol

2-chlorohex-2-en-1-ol (PubChem CID 130125414) has the molecular formula C6H11ClO and a molecular weight of 134.61 g/mol. Its IUPAC name is 2-chlorohex-2-en-1-ol.

Molecular Properties

Compound Name2-chlorohex-2-en-1-ol
PubChem CID130125414
Molecular FormulaC6H11ClO
Molecular Weight134.61 g/mol
Exact Mass134.05
IUPAC Name2-chlorohex-2-en-1-ol
SMILESCCCC=C(Cl)CO
InChIInChI=1S/C6H11ClO/c1-2-3-4-6(7)5-8/h4,8H,2-3,5H2,1H3
InChIKeyMZZQWZRZHJVAAB-UHFFFAOYSA-N
XLogP1.90
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.61
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(E)-2-chlorohex-2-ene
CID 19796923
1-bromo-1-chloropent-1-ene
CID 535956
(Z)-2-bromohex-2-en-1-ol
CID 23238559
(Z)-2-chlorobut-2-en-1-ol
CID 15287200
1,3-dichlorohepta-1,3-diene
CID 154209919
(3E)-3-chlorohepta-1,3-diene
CID 88589148
(E)-1-chloro-1-ethylselanylpent-1-ene
CID 134920853
(Z)-1,2-dichlorohept-2-ene
CID 55302648
pent-1-ene-1,1-diol
CID 21473005
(E)-1,1,1-trichlorohex-2-en-2-ol
CID 88736650
(2Z)-2-butylidenepentane-1,4-diol
CID 100944358
methyl (Z)-2-chlorohex-2-enoate
CID 12547214

Frequently Asked Questions

What is the IUPAC name of 2-chlorohex-2-en-1-ol?
The IUPAC name of 2-chlorohex-2-en-1-ol (CID 130125414) is 2-chlorohex-2-en-1-ol.
What is the SMILES notation for 2-chlorohex-2-en-1-ol?
The canonical SMILES for 2-chlorohex-2-en-1-ol is CCCC=C(Cl)CO.
What is the InChIKey of 2-chlorohex-2-en-1-ol?
The InChIKey is MZZQWZRZHJVAAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11ClO/c1-2-3-4-6(7)5-8/h4,8H,2-3,5H2,1H3.
What are the key properties of 2-chlorohex-2-en-1-ol?
2-chlorohex-2-en-1-ol has a molecular weight of 134.61 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chlorohex-2-en-1-ol is sourced from PubChem (CID 130125414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).