(Z)-6-chloro-3-methylhex-2-en-1-ol

C7H13ClO — CID 55298259

IUPAC(Z)-6-chloro-3-methylhex-2-en-1-ol
SMILESC/C(=C/CO)CCCCl
InChIInChI=1S/C7H13ClO/c1-7(4-6-9)3-2-5-8/h4,9H,2-3,5-6H2,1H3/b7-4-
InChIKeyJUGFUGDZRVXMCS-DAXSKMNVSA-N
MW148.63 g/mol
LogP1.94
Rot. Bonds4

About (Z)-6-chloro-3-methylhex-2-en-1-ol

(Z)-6-chloro-3-methylhex-2-en-1-ol (PubChem CID 55298259) has the molecular formula C7H13ClO and a molecular weight of 148.63 g/mol. Its IUPAC name is (Z)-6-chloro-3-methylhex-2-en-1-ol.

Molecular Properties

Compound Name(Z)-6-chloro-3-methylhex-2-en-1-ol
PubChem CID55298259
Molecular FormulaC7H13ClO
Molecular Weight148.63 g/mol
Exact Mass148.07
IUPAC Name(Z)-6-chloro-3-methylhex-2-en-1-ol
SMILESC/C(=C/CO)CCCCl
InChIInChI=1S/C7H13ClO/c1-7(4-6-9)3-2-5-8/h4,9H,2-3,5-6H2,1H3/b7-4-
InChIKeyJUGFUGDZRVXMCS-DAXSKMNVSA-N
XLogP1.94
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.63
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(Z)-3-methylpent-2-ene-1,5-diol
CID 12561740
3,7,11-trimethyldodeca-2,7,10-trien-1-ol
CID 54253361
5-amino-3-methylpent-2-en-1-ol
CID 167443308
actinium;bis(3-methylhex-2-en-1-ol)
CID 160943648
(2E)-3,7-dimethyldodeca-2,6-dien-1-ol
CID 141351623
(3Z)-7-chloro-4-methylhepta-1,3-diene
CID 130195022
(E)-3,7,11,15-tetramethyl(2,5,6,9,10,13,14-13C7)hexadec-2-en-1-ol
CID 10638184
CID 101056745
CID 101056745
(2E,6E,10E,14E,18E,22E,26Z,30Z,34Z)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-ol
CID 172806438
3-methylocta-2,6-dien-1-ol
CID 57183202
(2E)-3,7-dimethylocta-2,6-dien-1-ol;hydrochloride
CID 126649589
(2Z,6E,10E,14E)-3,7,11,15,19-pentamethylicosa-2,6,10,14,18-pentaen-1-ol
CID 90659053

Frequently Asked Questions

What is the IUPAC name of (Z)-6-chloro-3-methylhex-2-en-1-ol?
The IUPAC name of (Z)-6-chloro-3-methylhex-2-en-1-ol (CID 55298259) is (Z)-6-chloro-3-methylhex-2-en-1-ol.
What is the SMILES notation for (Z)-6-chloro-3-methylhex-2-en-1-ol?
The canonical SMILES for (Z)-6-chloro-3-methylhex-2-en-1-ol is C/C(=C/CO)CCCCl.
What is the InChIKey of (Z)-6-chloro-3-methylhex-2-en-1-ol?
The InChIKey is JUGFUGDZRVXMCS-DAXSKMNVSA-N. The full InChI is InChI=1S/C7H13ClO/c1-7(4-6-9)3-2-5-8/h4,9H,2-3,5-6H2,1H3/b7-4-.
What are the key properties of (Z)-6-chloro-3-methylhex-2-en-1-ol?
(Z)-6-chloro-3-methylhex-2-en-1-ol has a molecular weight of 148.63 g/mol, XLogP of 1.94, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-6-chloro-3-methylhex-2-en-1-ol is sourced from PubChem (CID 55298259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).