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116681 58 4 | Cheminformatics

Chemical : (2,3-Difluorophenyl)hydrazine

Casrn : 116681-58-4

MolName : (2,3-Difluorophenyl)hydrazine

MolecularFormula : C6H6N2F2

Smiles : NNc1cccc(F)c1F

InChI : InChI=1S/C6H6F2N2/c7-4-2-1-3-5(10-9)6(4)8/h1-3,10H,9H2

InChIK : KUZSKMQWYVHGFE-UHFFFAOYSA-N

CanonicalSyTyLFy : 54ec4501f092f869

TotalMolweight : 144.124

Molweight : 144.124

MonoisotopicMass : 144.049904

CLogP : 1.8237

CLogS : -2.038

H Acceptors : 2

H Donors : 2

TotalSurfaceArea : 105.94

Relative PSA : 0.25231

PolarSurfaceArea : 38.05

Druglikeness : -5.6624

Mutagenic : none

Tumorigenic : high

Reproductive Effective : none

Irritant : none

Nasty Functions : hydrazine

Shape Index : 0.6

Molecula Flexibility : 0.017819

Molecular Complexity : 0.68024

Fragments : 1

Non HAtoms : 10

NonCHAtoms : 4

Electronegative Atoms : 4

Rotatable Bond : 1

Rings Closures : 1

Small Rings : 1

Aromatic Rings : 1

Aromatic Atoms : 6

Sp3Atoms : 1

StereoCon :

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100-68-5nonenonenoneC7H8S124.207-1.735
100019-64-5nonenonenoneC9H10N2O7FP308.157-34.083
1000-63-1nonenonehighC8H18O130.23-19.78
100009-01-6nonenonenoneC15H13N3O3283.286-2.3895
017257-81-7nonenonenoneC6H10O2114.1430.9106
1000018-56-3nonenonenoneC7H4N3O2Br242.032-0.39052
1000-56-2nonenonenoneC3H7O4S.Na139.151-6.9141
100021-81-6nonenonenoneH3O4P.C20H42N2O326.566-22.282
100-75-4highhighhighC5H10N2O114.147-0.86877
1000269-67-9nonenonenoneC13H22N4234.3460.99367
10-00-4nonenonenoneC28H34O8498.57-4.8409
100004-54-4nonehighnoneC4H8Te183.708-3.9699
10003-69-7nonenonenoneC10H14O8S4390.4770.2775
10-35-5nonenonenoneC4H6O2BrF184.992-23.473
100-53-8nonehighhighC7H8S124.207-6.3177
100002-29-7nonenonenoneC12H18N2O3238.2862.8956
1000000-13-4highhighhighC21H28O12472.441-0.17986
1000017-92-4nonenonenoneC6H4NBr2Cl285.366-3.6
1000018-48-3nonenonenoneC12H15NO4S269.321.5148
100021-47-4nonenonenoneC13H17N5O6339.307-2.7249
1000010-11-6nonenonenoneC28H44N2O2440.669-21.689
100-64-1highhighnoneC6H11NO113.159-6.4182
1000303-67-2nonenonenoneC6H8N2O124.1432.717
1000025-92-2nonenonenoneC20H16N2O2316.359-6.3825
10003-67-5nonenonenoneC33H62O6554.849-22.973
1000-68-6nonenonenoneC3H9NO3S2171.24-3.0843
100027-33-6nonenonenoneI.C21H27N2O323.4583.6949
1000339-36-5nonenonenoneC16H19NO3S305.397-3.4866
100-07-2highhighlowC8H7O2Cl170.595-10.49
100-39-0highhighnoneC7H7Br171.037-7.8241
1000018-24-5nonenonenoneC12H18N4O3266.3-0.33651
1000017-93-5nonenonenoneC8H5N2O2Cl196.5932.9136
100-25-4nonenonenoneC6H4N2O4168.108-7.74
1000-36-8nonenonenoneC11H25O3P236.29-27.011
100-96-9highnonenoneC7H10N2O138.169-1.7412
100020-34-6nonenonenoneC13H18S2238.418-0.23079
10-13-2009nonenonenoneC15H14O5274.271-1.4702
1000339-26-3nonenonenoneC14H7N2OBrCl2370.033-0.59356
10000-20-1nonelowhighC12H32N2Si2260.572-64.51
10000-42-7highhighlowC20H18N4O3362.388-5.7793
1000269-51-1nonenonenoneC13H12NO4B257.052-12.285
1000-30-2nonenonehighC9H16O140.225-7.4662
1000-40-4highnonelowC10H24S2Sn327.143-7.0269
100-34-5nonenonenoneCl.C6H5N2105.12-4.365
100-55-0nonenonenoneC6H7NO109.128-1.9045
100008-90-0nonenonenoneC12H11N3O3245.237-1.9187
100-19-6nonenonenoneC8H7NO3165.148-7.0365
100027-90-5highhighnoneC20H26N2Cl2.HCl.HCl365.3464.1664
100-67-4nonenonenoneK.C6H5O93.1047-2.2548
100032-79-9nonehighnoneC6H6N3O2Br.HCl232.037-11.653
1000160-75-7nonenonelowC14H17O2BS260.164-20.35
100-48-1nonenonenoneC6H4N2104.112-6.0498
100-87-8nonenonenoneC7H8O3S172.204-10.732
1000-91-5nonenonehighC5H14OSi118.251-35.679
100007-62-3nonenonehighC8H13NO139.197-8.1398
100031-98-9nonenonehighC12H29O4F3Si4406.696-100.78
1000160-97-3nonenonenoneC24H28N2O3.C11H8O3392.4971.9926
1000018-21-2nonenonenoneC17H25N3O6S399.467-41.344
100010-99-9nonenonenoneC11H24O2188.31-23.185
100011-00-5nonenonenoneC15H24O2236.354-18.044