AC67485
717101-37-6 | 2-(3,5-Difluorophenyl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AC67485
ChemicalName
2-(3,5-Difluorophenyl)benzonitrile
CasNumber
717101-37-6
MolecularFormula
C13H7F2N
MolecularWeight
215.1982
MdlNumber
MFCD20529502
Smiles
N#Cc1ccccc1c1cc(F)cc(c1)F
Complexity
273
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
3.5
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CatalogNumber: AC67485
ChemicalName: 2-(3,5-Difluorophenyl)benzonitrile
CasNumber: 717101-37-6
MolecularFormula: C13H7F2N
MolecularWeight: 215.1982
MdlNumber: MFCD20529502
Smiles: N#Cc1ccccc1c1cc(F)cc(c1)F
Complexity: 273
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 3.5
CatalogNumber:
AC67485
ChemicalName:
2-(3,5-Difluorophenyl)benzonitrile
CasNumber:
717101-37-6
MolecularFormula:
C13H7F2N
MolecularWeight:
215.1982
MdlNumber:
MFCD20529502
Smiles:
N#Cc1ccccc1c1cc(F)cc(c1)F
Complexity:
273
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
3.5
CatalogNumber: AC67491
ChemicalName: N-(4-Bromophenyl)-1,3-propanesultam
CasNumber: 71703-16-7
MolecularFormula: C9H10BrNO2S
MolecularWeight: 276.1502
MdlNumber: MFCD09933347
Smiles: Brc1ccc(cc1)N1CCCS1(=O)=O
Complexity: 290
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 1.9
CatalogNumber:
AC67491
ChemicalName:
N-(4-Bromophenyl)-1,3-propanesultam
CasNumber:
71703-16-7
MolecularFormula:
C9H10BrNO2S
MolecularWeight:
276.1502
MdlNumber:
MFCD09933347
Smiles:
Brc1ccc(cc1)N1CCCS1(=O)=O
Complexity:
290
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1cnc(c(c1)C(F)F)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1cnc(c(c1)C(F)F)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AC67493
ChemicalName: Ethyl 3-hydroxy-4-nitrobenzoate
CasNumber: 717-01-1
MolecularFormula: C9H9NO5
MolecularWeight: 211.1715
MdlNumber: MFCD06204637
Smiles: CCOC(=O)c1ccc(c(c1)O)[N+](=O)[O-]
Complexity: 249
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 2.7
CatalogNumber:
AC67493
ChemicalName:
Ethyl 3-hydroxy-4-nitrobenzoate
CasNumber:
717-01-1
MolecularFormula:
C9H9NO5
MolecularWeight:
211.1715
MdlNumber:
MFCD06204637
Smiles:
CCOC(=O)c1ccc(c(c1)O)[N+](=O)[O-]
Complexity:
249
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
2.7