AB49395
454-79-5 | 3-Amino-4-bromobenzotrifluoride
Manufacturer: A2B Chem
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CatalogNumber
AB49395
ChemicalName
3-Amino-4-bromobenzotrifluoride
CasNumber
454-79-5
MolecularFormula
C7H5BrF3N
MolecularWeight
240.0205
MdlNumber
MFCD00007637
Smiles
Brc1ccc(cc1N)C(F)(F)F
NscNumber
88276
Complexity
159
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
Xlogp3
3.1
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CatalogNumber: AB49395
ChemicalName: 3-Amino-4-bromobenzotrifluoride
CasNumber: 454-79-5
MolecularFormula: C7H5BrF3N
MolecularWeight: 240.0205
MdlNumber: MFCD00007637
Smiles: Brc1ccc(cc1N)C(F)(F)F
NscNumber: 88276
Complexity: 159
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
Xlogp3: 3.1
CatalogNumber:
AB49395
ChemicalName:
3-Amino-4-bromobenzotrifluoride
CasNumber:
454-79-5
MolecularFormula:
C7H5BrF3N
MolecularWeight:
240.0205
MdlNumber:
MFCD00007637
Smiles:
Brc1ccc(cc1N)C(F)(F)F
NscNumber:
88276
Complexity:
159
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
Xlogp3:
3.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc2c(c1)nc(cc2)Cl
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc2c(c1)nc(cc2)Cl
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCc1ccc2c(c1)cn[nH]2
NscNumber: __
Complexity: 137
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: 0.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCc1ccc2c(c1)cn[nH]2
NscNumber:
__
Complexity:
137
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
0.6
CatalogNumber: AB49398
ChemicalName: 3-Pyrazol-1-yl-phenylboronic acid
CasNumber: 476620-22-1
MolecularFormula: C9H9BN2O2
MolecularWeight: 187.991
MdlNumber: MFCD05864582
Smiles: OB(c1cccc(c1)n1cccn1)O
NscNumber: __
Complexity: 192
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
Xlogp3: __
CatalogNumber:
AB49398
ChemicalName:
3-Pyrazol-1-yl-phenylboronic acid
CasNumber:
476620-22-1
MolecularFormula:
C9H9BN2O2
MolecularWeight:
187.991
MdlNumber:
MFCD05864582
Smiles:
OB(c1cccc(c1)n1cccn1)O
NscNumber:
__
Complexity:
192
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
Xlogp3:
__