AG19732
54321-80-1 | 3-Bromo-5-nitrobenzamide
Manufacturer: A2B Chem
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CatalogNumber
AG19732
ChemicalName
3-Bromo-5-nitrobenzamide
CasNumber
54321-80-1
MolecularFormula
C7H5BrN2O3
MolecularWeight
245.0302
MdlNumber
MFCD01529620
Smiles
Brc1cc(cc(c1)C(=O)N)[N+](=O)[O-]
Complexity
228
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.7
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CatalogNumber: AG19732
ChemicalName: 3-Bromo-5-nitrobenzamide
CasNumber: 54321-80-1
MolecularFormula: C7H5BrN2O3
MolecularWeight: 245.0302
MdlNumber: MFCD01529620
Smiles: Brc1cc(cc(c1)C(=O)N)[N+](=O)[O-]
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.7
CatalogNumber:
AG19732
ChemicalName:
3-Bromo-5-nitrobenzamide
CasNumber:
54321-80-1
MolecularFormula:
C7H5BrN2O3
MolecularWeight:
245.0302
MdlNumber:
MFCD01529620
Smiles:
Brc1cc(cc(c1)C(=O)N)[N+](=O)[O-]
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1cccc2c1c(=O)nc[nH]2
Complexity: 229
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1cccc2c1c(=O)nc[nH]2
Complexity:
229
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.8
CatalogNumber: AG19734
ChemicalName: 4-(Pyrrolidinylcarbonyl)bromobenzene
CasNumber: 5543-27-1
MolecularFormula: C11H12BrNO
MolecularWeight: 254.1230800000001
MdlNumber: MFCD00595283
Smiles: O=C(c1ccc(cc1)Br)N1CCCC1
Complexity: 205
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 2.6
CatalogNumber:
AG19734
ChemicalName:
4-(Pyrrolidinylcarbonyl)bromobenzene
CasNumber:
5543-27-1
MolecularFormula:
C11H12BrNO
MolecularWeight:
254.1230800000001
MdlNumber:
MFCD00595283
Smiles:
O=C(c1ccc(cc1)Br)N1CCCC1
Complexity:
205
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
2.6
CatalogNumber: AG19735
ChemicalName: 3-Fluoro-4-isopropoxyphenylboronic acid
CasNumber: 480438-54-8
MolecularFormula: C9H12BFO3
MolecularWeight: 197.9992
MdlNumber: MFCD05865163
Smiles: CC(Oc1ccc(cc1F)B(O)O)C
Complexity: 177
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AG19735
ChemicalName:
3-Fluoro-4-isopropoxyphenylboronic acid
CasNumber:
480438-54-8
MolecularFormula:
C9H12BFO3
MolecularWeight:
197.9992
MdlNumber:
MFCD05865163
Smiles:
CC(Oc1ccc(cc1F)B(O)O)C
Complexity:
177
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
__