(Z)-12-bromododec-3-en-1-ol

C12H23BrO — CID 163205087

IUPAC(Z)-12-bromododec-3-en-1-ol
SMILESOCC/C=C\CCCCCCCCBr
InChIInChI=1S/C12H23BrO/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h6,8,14H,1-5,7,9-12H2/b8-6-
InChIKeyDMWUTRXMJNRCNS-VURMDHGXSA-N
MW263.22 g/mol
LogP4.05
Rot. Bonds10

About (Z)-12-bromododec-3-en-1-ol

(Z)-12-bromododec-3-en-1-ol (PubChem CID 163205087) has the molecular formula C12H23BrO and a molecular weight of 263.22 g/mol. Its IUPAC name is (Z)-12-bromododec-3-en-1-ol.

Molecular Properties

Compound Name(Z)-12-bromododec-3-en-1-ol
PubChem CID163205087
Molecular FormulaC12H23BrO
Molecular Weight263.22 g/mol
Exact Mass262.09
IUPAC Name(Z)-12-bromododec-3-en-1-ol
SMILESOCC/C=C\CCCCCCCCBr
InChIInChI=1S/C12H23BrO/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h6,8,14H,1-5,7,9-12H2/b8-6-
InChIKeyDMWUTRXMJNRCNS-VURMDHGXSA-N
XLogP4.05
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.22
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (Z)-12-bromododec-3-en-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-17-bromoheptadec-3-en-1-ol
CID 163204836
(Z)-21-bromohenicos-11-en-1-ol
CID 134982012
(E)-7-bromohept-3-en-1-ol
CID 163205000
1,25-dibromopentacos-12-ene
CID 168864699
7-bromohept-2-en-1-ol
CID 85361103
1,12-dibromododec-2-ene
CID 54440565
(3Z,6Z,9Z,12Z,15Z,18Z)-28-bromooctacosa-3,6,9,12,15,18-hexaene;(10Z,13Z,16Z,19Z,22Z,25Z)-octacosa-10,13,16,19,22,25-hexaen-1-ol
CID 160855326
1,7-dibromohept-2-ene
CID 171472304
(Z)-13-chlorotridec-3-en-1-ol
CID 163204990
(E)-12-bromododec-3-ene
CID 20561604
(E)-heptadec-3-en-1-ol
CID 170849265
heptadec-3-en-1-ol
CID 86130004

Frequently Asked Questions

What is the IUPAC name of (Z)-12-bromododec-3-en-1-ol?
The IUPAC name of (Z)-12-bromododec-3-en-1-ol (CID 163205087) is (Z)-12-bromododec-3-en-1-ol.
What is the SMILES notation for (Z)-12-bromododec-3-en-1-ol?
The canonical SMILES for (Z)-12-bromododec-3-en-1-ol is OCC/C=C\CCCCCCCCBr.
What is the InChIKey of (Z)-12-bromododec-3-en-1-ol?
The InChIKey is DMWUTRXMJNRCNS-VURMDHGXSA-N. The full InChI is InChI=1S/C12H23BrO/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h6,8,14H,1-5,7,9-12H2/b8-6-.
What are the key properties of (Z)-12-bromododec-3-en-1-ol?
(Z)-12-bromododec-3-en-1-ol has a molecular weight of 263.22 g/mol, XLogP of 4.05, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-12-bromododec-3-en-1-ol is sourced from PubChem (CID 163205087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).