AB52714
501420-63-9 | 2-(3-Bromo-4-fluorophenyl)acetonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB52714
ChemicalName
2-(3-Bromo-4-fluorophenyl)acetonitrile
CasNumber
501420-63-9
MolecularFormula
C8H5BrFN
MolecularWeight
214.0344
MdlNumber
MFCD08458154
Smiles
N#CCc1ccc(c(c1)Br)F
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
2.4
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CatalogNumber: AB52714
ChemicalName: 2-(3-Bromo-4-fluorophenyl)acetonitrile
CasNumber: 501420-63-9
MolecularFormula: C8H5BrFN
MolecularWeight: 214.0344
MdlNumber: MFCD08458154
Smiles: N#CCc1ccc(c(c1)Br)F
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 2.4
CatalogNumber:
AB52714
ChemicalName:
2-(3-Bromo-4-fluorophenyl)acetonitrile
CasNumber:
501420-63-9
MolecularFormula:
C8H5BrFN
MolecularWeight:
214.0344
MdlNumber:
MFCD08458154
Smiles:
N#CCc1ccc(c(c1)Br)F
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
2.4
CatalogNumber: AB52715
ChemicalName: 3-Bromo-2-(bromomethyl)pyridine
CasNumber: 754131-60-7
MolecularFormula: C6H5Br2N
MolecularWeight: 250.9186
MdlNumber: MFCD09999976
Smiles: BrCc1ncccc1Br
Complexity: 87.1
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AB52715
ChemicalName:
3-Bromo-2-(bromomethyl)pyridine
CasNumber:
754131-60-7
MolecularFormula:
C6H5Br2N
MolecularWeight:
250.9186
MdlNumber:
MFCD09999976
Smiles:
BrCc1ncccc1Br
Complexity:
87.1
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC1(CC1)c1ccc(cc1)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC1(CC1)c1ccc(cc1)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB52717
ChemicalName: Ethyl 2-amino-1H-pyrrole-3-carboxylate
CasNumber: 108290-86-4
MolecularFormula: C7H10N2O2
MolecularWeight: 154.1665
MdlNumber: MFCD00027834
Smiles: CCOC(=O)c1cc[nH]c1N
Complexity: 149
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 1.1
CatalogNumber:
AB52717
ChemicalName:
Ethyl 2-amino-1H-pyrrole-3-carboxylate
CasNumber:
108290-86-4
MolecularFormula:
C7H10N2O2
MolecularWeight:
154.1665
MdlNumber:
MFCD00027834
Smiles:
CCOC(=O)c1cc[nH]c1N
Complexity:
149
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
1.1