[2-chloro-2,2-difluoro-1-(4-methoxyphenyl)ethyl]hydrazine

C9H11ClF2N2O — CID 105265477

IUPAC[2-chloro-2,2-difluoro-1-(4-methoxyphenyl)ethyl]hydrazine
SMILESCOc1ccc(C(NN)C(F)(F)Cl)cc1
InChIInChI=1S/C9H11ClF2N2O/c1-15-7-4-2-6(3-5-7)8(14-13)9(10,11)12/h2-5,8,14H,13H2,1H3
InChIKeyRIIBEKHZOYBZAX-UHFFFAOYSA-N
MW236.65 g/mol
LogP2.03
Rot. Bonds4

About [2-chloro-2,2-difluoro-1-(4-methoxyphenyl)ethyl]hydrazine

[2-chloro-2,2-difluoro-1-(4-methoxyphenyl)ethyl]hydrazine (PubChem CID 105265477) has the molecular formula C9H11ClF2N2O and a molecular weight of 236.65 g/mol. Its IUPAC name is [2-chloro-2,2-difluoro-1-(4-methoxyphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-chloro-2,2-difluoro-1-(4-methoxyphenyl)ethyl]hydrazine
PubChem CID105265477
Molecular FormulaC9H11ClF2N2O
Molecular Weight236.65 g/mol
Exact Mass236.05
IUPAC Name[2-chloro-2,2-difluoro-1-(4-methoxyphenyl)ethyl]hydrazine
SMILESCOc1ccc(C(NN)C(F)(F)Cl)cc1
InChIInChI=1S/C9H11ClF2N2O/c1-15-7-4-2-6(3-5-7)8(14-13)9(10,11)12/h2-5,8,14H,13H2,1H3
InChIKeyRIIBEKHZOYBZAX-UHFFFAOYSA-N
XLogP2.03
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.65
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[2-chloro-1-(3,5-dimethoxyphenyl)-2,2-difluoroethyl]hydrazine
CID 105265581
[2-chloro-2,2-difluoro-1-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine
CID 105265555
[2-ethyl-2-methoxy-1-(4-methoxyphenyl)butyl]hydrazine
CID 105275411
[2,2-dimethyl-1-[4-(trifluoromethoxy)phenyl]propyl]hydrazine
CID 105305314
[2-chloro-1-(3,4-dimethylphenyl)-2,2-difluoroethyl]hydrazine
CID 105265553
[3,3,3-trifluoro-1-(4-methoxyphenyl)propyl]hydrazine
CID 105206009
[(4-methoxyphenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105190882
[(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine
CID 105190992
CID 67872318
CID 67872318
methoxymethane;1-methoxy-4-[2,2,2-trichloro-1-(4-methoxyphenyl)ethyl]benzene
CID 174660732
[1-(4-methoxyphenyl)-2-methyl-2-piperidin-1-ylbutyl]hydrazine
CID 105241337
[2-chloro-1-(3-ethylphenyl)-2,2-difluoroethyl]hydrazine
CID 105265335

Frequently Asked Questions

What is the IUPAC name of [2-chloro-2,2-difluoro-1-(4-methoxyphenyl)ethyl]hydrazine?
The IUPAC name of [2-chloro-2,2-difluoro-1-(4-methoxyphenyl)ethyl]hydrazine (CID 105265477) is [2-chloro-2,2-difluoro-1-(4-methoxyphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-chloro-2,2-difluoro-1-(4-methoxyphenyl)ethyl]hydrazine?
The canonical SMILES for [2-chloro-2,2-difluoro-1-(4-methoxyphenyl)ethyl]hydrazine is COc1ccc(C(NN)C(F)(F)Cl)cc1.
What is the InChIKey of [2-chloro-2,2-difluoro-1-(4-methoxyphenyl)ethyl]hydrazine?
The InChIKey is RIIBEKHZOYBZAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClF2N2O/c1-15-7-4-2-6(3-5-7)8(14-13)9(10,11)12/h2-5,8,14H,13H2,1H3.
What are the key properties of [2-chloro-2,2-difluoro-1-(4-methoxyphenyl)ethyl]hydrazine?
[2-chloro-2,2-difluoro-1-(4-methoxyphenyl)ethyl]hydrazine has a molecular weight of 236.65 g/mol, XLogP of 2.03, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-chloro-2,2-difluoro-1-(4-methoxyphenyl)ethyl]hydrazine is sourced from PubChem (CID 105265477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).