(1-chloro-1,1-difluorohept-6-en-2-yl)hydrazine

C7H13ClF2N2 — CID 105265347

IUPAC(1-chloro-1,1-difluorohept-6-en-2-yl)hydrazine
SMILESC=CCCCC(NN)C(F)(F)Cl
InChIInChI=1S/C7H13ClF2N2/c1-2-3-4-5-6(12-11)7(8,9)10/h2,6,12H,1,3-5,11H2
InChIKeyBWKIQBXQBZQBMH-UHFFFAOYSA-N
MW198.64 g/mol
LogP2.01
Rot. Bonds6

About (1-chloro-1,1-difluorohept-6-en-2-yl)hydrazine

(1-chloro-1,1-difluorohept-6-en-2-yl)hydrazine (PubChem CID 105265347) has the molecular formula C7H13ClF2N2 and a molecular weight of 198.64 g/mol. Its IUPAC name is (1-chloro-1,1-difluorohept-6-en-2-yl)hydrazine.

Molecular Properties

Compound Name(1-chloro-1,1-difluorohept-6-en-2-yl)hydrazine
PubChem CID105265347
Molecular FormulaC7H13ClF2N2
Molecular Weight198.64 g/mol
Exact Mass198.07
IUPAC Name(1-chloro-1,1-difluorohept-6-en-2-yl)hydrazine
SMILESC=CCCCC(NN)C(F)(F)Cl
InChIInChI=1S/C7H13ClF2N2/c1-2-3-4-5-6(12-11)7(8,9)10/h2,6,12H,1,3-5,11H2
InChIKeyBWKIQBXQBZQBMH-UHFFFAOYSA-N
XLogP2.01
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.64
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

1,1,1-Trifluorooct-7-en-3-ylhydrazine
CID 105205883
1,1,1-Trifluorohept-6-en-3-ylhydrazine
CID 105205989
1,1,1-Trifluorohept-6-en-2-ylhydrazine
CID 105215585
1,1,1-Trifluorohex-5-en-2-ylhydrazine
CID 105215684
7,7,7-Trifluorohept-1-en-4-ylhydrazine
CID 105249018
1,1-Difluorohept-6-en-2-ylhydrazine
CID 105264991
1,1-Difluorohex-5-en-2-ylhydrazine
CID 105265091
(1-Chloro-1,1-difluoro-5-methylhex-5-en-2-yl)hydrazine
CID 105265441
(1-Chloro-1,1-difluorohex-5-en-2-yl)hydrazine
CID 105265457
(1-Chloro-1,1-difluoropent-4-en-2-yl)hydrazine
CID 105265522
(1-Chloro-1,1-difluoro-4-methylpent-4-en-2-yl)hydrazine
CID 105265599
(1-Chloro-1,1-difluoro-4-methylidenehexan-2-yl)hydrazine
CID 105265607

Frequently Asked Questions

What is the IUPAC name of (1-chloro-1,1-difluorohept-6-en-2-yl)hydrazine?
The IUPAC name of (1-chloro-1,1-difluorohept-6-en-2-yl)hydrazine (CID 105265347) is (1-chloro-1,1-difluorohept-6-en-2-yl)hydrazine.
What is the SMILES notation for (1-chloro-1,1-difluorohept-6-en-2-yl)hydrazine?
The canonical SMILES for (1-chloro-1,1-difluorohept-6-en-2-yl)hydrazine is C=CCCCC(NN)C(F)(F)Cl.
What is the InChIKey of (1-chloro-1,1-difluorohept-6-en-2-yl)hydrazine?
The InChIKey is BWKIQBXQBZQBMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13ClF2N2/c1-2-3-4-5-6(12-11)7(8,9)10/h2,6,12H,1,3-5,11H2.
What are the key properties of (1-chloro-1,1-difluorohept-6-en-2-yl)hydrazine?
(1-chloro-1,1-difluorohept-6-en-2-yl)hydrazine has a molecular weight of 198.64 g/mol, XLogP of 2.01, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-chloro-1,1-difluorohept-6-en-2-yl)hydrazine is sourced from PubChem (CID 105265347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).