AA29327
124840-61-5 | 2-(5-Bromo-2-nitrophenyl)acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AA29327
ChemicalName
2-(5-Bromo-2-nitrophenyl)acetic acid
CasNumber
124840-61-5
MolecularFormula
C8H6BrNO4
MolecularWeight
260.0415
MdlNumber
MFCD01096363
Smiles
OC(=O)Cc1cc(Br)ccc1[N+](=O)[O-]
Complexity
240
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.9
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CatalogNumber: AA29327
ChemicalName: 2-(5-Bromo-2-nitrophenyl)acetic acid
CasNumber: 124840-61-5
MolecularFormula: C8H6BrNO4
MolecularWeight: 260.0415
MdlNumber: MFCD01096363
Smiles: OC(=O)Cc1cc(Br)ccc1[N+](=O)[O-]
Complexity: 240
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.9
CatalogNumber:
AA29327
ChemicalName:
2-(5-Bromo-2-nitrophenyl)acetic acid
CasNumber:
124840-61-5
MolecularFormula:
C8H6BrNO4
MolecularWeight:
260.0415
MdlNumber:
MFCD01096363
Smiles:
OC(=O)Cc1cc(Br)ccc1[N+](=O)[O-]
Complexity:
240
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#CCc1ccc(c(c1)Br)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#CCc1ccc(c(c1)Br)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA29329
ChemicalName: 4-Hydrazinyl-3-nitrobenzonitrile
CasNumber: 124839-61-8
MolecularFormula: C7H6N4O2
MolecularWeight: 178.1481
MdlNumber: MFCD00051699
Smiles: NNc1ccc(cc1[N+](=O)[O-])C#N
Complexity: 241
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.3
CatalogNumber:
AA29329
ChemicalName:
4-Hydrazinyl-3-nitrobenzonitrile
CasNumber:
124839-61-8
MolecularFormula:
C7H6N4O2
MolecularWeight:
178.1481
MdlNumber:
MFCD00051699
Smiles:
NNc1ccc(cc1[N+](=O)[O-])C#N
Complexity:
241
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1cccc(c1O)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1cccc(c1O)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__