AA30696
1255574-54-9 | 4-Bromo-5-isopropoxy-2-nitroaniline
Manufacturer: A2B Chem
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CatalogNumber
AA30696
ChemicalName
4-Bromo-5-isopropoxy-2-nitroaniline
CasNumber
1255574-54-9
MolecularFormula
C9H11BrN2O3
MolecularWeight
275.0992
MdlNumber
MFCD17214235
Smiles
CC(Oc1cc(N)c(cc1Br)[N+](=O)[O-])C
Complexity
232
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
3.1
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CatalogNumber: AA30696
ChemicalName: 4-Bromo-5-isopropoxy-2-nitroaniline
CasNumber: 1255574-54-9
MolecularFormula: C9H11BrN2O3
MolecularWeight: 275.0992
MdlNumber: MFCD17214235
Smiles: CC(Oc1cc(N)c(cc1Br)[N+](=O)[O-])C
Complexity: 232
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.1
CatalogNumber:
AA30696
ChemicalName:
4-Bromo-5-isopropoxy-2-nitroaniline
CasNumber:
1255574-54-9
MolecularFormula:
C9H11BrN2O3
MolecularWeight:
275.0992
MdlNumber:
MFCD17214235
Smiles:
CC(Oc1cc(N)c(cc1Br)[N+](=O)[O-])C
Complexity:
232
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.1
CatalogNumber: AA30697
ChemicalName: 4-Bromo-2-nitro-5-propoxyaniline
CasNumber: 1255574-53-8
MolecularFormula: C9H11BrN2O3
MolecularWeight: 275.0992
MdlNumber: MFCD17214233
Smiles: CCCOc1cc(N)c(cc1Br)[N+](=O)[O-]
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.2
CatalogNumber:
AA30697
ChemicalName:
4-Bromo-2-nitro-5-propoxyaniline
CasNumber:
1255574-53-8
MolecularFormula:
C9H11BrN2O3
MolecularWeight:
275.0992
MdlNumber:
MFCD17214233
Smiles:
CCCOc1cc(N)c(cc1Br)[N+](=O)[O-]
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1cc(Br)c(cc1N)OCCCCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1cc(Br)c(cc1N)OCCCCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(NC(C)(C)C)Cc1ccc(cn1)[N+](=O)[O-]
Complexity: 293
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(NC(C)(C)C)Cc1ccc(cn1)[N+](=O)[O-]
Complexity:
293
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.9