[3-chloro-2-fluoro-5,6-bis(prop-2-enyl)phenyl]hydrazine

C12H14ClFN2 — CID 175395544

IUPAC[3-chloro-2-fluoro-5,6-bis(prop-2-enyl)phenyl]hydrazine
SMILESC=CCc1cc(Cl)c(F)c(NN)c1CC=C
InChIInChI=1S/C12H14ClFN2/c1-3-5-8-7-10(13)11(14)12(16-15)9(8)6-4-2/h3-4,7,16H,1-2,5-6,15H2
InChIKeyAHHWIKTWUJHGBL-UHFFFAOYSA-N
MW240.71 g/mol
LogP3.22
Rot. Bonds5

About [3-chloro-2-fluoro-5,6-bis(prop-2-enyl)phenyl]hydrazine

[3-chloro-2-fluoro-5,6-bis(prop-2-enyl)phenyl]hydrazine (PubChem CID 175395544) has the molecular formula C12H14ClFN2 and a molecular weight of 240.71 g/mol. Its IUPAC name is [3-chloro-2-fluoro-5,6-bis(prop-2-enyl)phenyl]hydrazine.

Molecular Properties

Compound Name[3-chloro-2-fluoro-5,6-bis(prop-2-enyl)phenyl]hydrazine
PubChem CID175395544
Molecular FormulaC12H14ClFN2
Molecular Weight240.71 g/mol
Exact Mass240.08
IUPAC Name[3-chloro-2-fluoro-5,6-bis(prop-2-enyl)phenyl]hydrazine
SMILESC=CCc1cc(Cl)c(F)c(NN)c1CC=C
InChIInChI=1S/C12H14ClFN2/c1-3-5-8-7-10(13)11(14)12(16-15)9(8)6-4-2/h3-4,7,16H,1-2,5-6,15H2
InChIKeyAHHWIKTWUJHGBL-UHFFFAOYSA-N
XLogP3.22
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.71
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3,4-dichloro-2,6-bis(prop-2-enyl)aniline
CID 88739383
3-chloro-4-prop-2-enylphenol
CID 70565458
4-chloro-3-prop-2-enylphenol
CID 67612288
1,2,4,5-tetrafluoro-3-prop-2-enylbenzene
CID 12944006
1,3-dichloro-2,4-bis(prop-2-enyl)benzene
CID 173196213
4-chloro-3-fluoro-2-N-prop-2-enylbenzene-1,2-diamine
CID 130507300
5-chloro-4-fluoro-2,3-dimethyl-6-prop-2-enylphenol
CID 130034498
3,4,5-tris(prop-2-enyl)benzoic acid
CID 69493065
(4-fluoro-2-prop-2-enylphenyl)-bis(prop-2-enyl)borane
CID 66925498
4-[bis(2-chloroethyl)aminomethyl]-3,5-bis(prop-2-enyl)aniline
CID 24847025
2-(2,4-dichloro-6-prop-2-enylphenoxy)acetohydrazide
CID 54849931
2-fluoro-3-methyl-6-prop-2-enylphenol
CID 107657766

Frequently Asked Questions

What is the IUPAC name of [3-chloro-2-fluoro-5,6-bis(prop-2-enyl)phenyl]hydrazine?
The IUPAC name of [3-chloro-2-fluoro-5,6-bis(prop-2-enyl)phenyl]hydrazine (CID 175395544) is [3-chloro-2-fluoro-5,6-bis(prop-2-enyl)phenyl]hydrazine.
What is the SMILES notation for [3-chloro-2-fluoro-5,6-bis(prop-2-enyl)phenyl]hydrazine?
The canonical SMILES for [3-chloro-2-fluoro-5,6-bis(prop-2-enyl)phenyl]hydrazine is C=CCc1cc(Cl)c(F)c(NN)c1CC=C.
What is the InChIKey of [3-chloro-2-fluoro-5,6-bis(prop-2-enyl)phenyl]hydrazine?
The InChIKey is AHHWIKTWUJHGBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14ClFN2/c1-3-5-8-7-10(13)11(14)12(16-15)9(8)6-4-2/h3-4,7,16H,1-2,5-6,15H2.
What are the key properties of [3-chloro-2-fluoro-5,6-bis(prop-2-enyl)phenyl]hydrazine?
[3-chloro-2-fluoro-5,6-bis(prop-2-enyl)phenyl]hydrazine has a molecular weight of 240.71 g/mol, XLogP of 3.22, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-chloro-2-fluoro-5,6-bis(prop-2-enyl)phenyl]hydrazine is sourced from PubChem (CID 175395544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).