AA40696
1311197-83-7 | 4-Bromo-2-nitro-5-propoxy-N-propylaniline
Manufacturer: A2B Chem
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CatalogNumber
AA40696
ChemicalName
4-Bromo-2-nitro-5-propoxy-N-propylaniline
CasNumber
1311197-83-7
MolecularFormula
C12H17BrN2O3
MolecularWeight
317.179
MdlNumber
MFCD19237157
Smiles
CCCNc1cc(OCCC)c(cc1[N+](=O)[O-])Br
Complexity
260
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
6
Xlogp3
4.7
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CatalogNumber: AA40696
ChemicalName: 4-Bromo-2-nitro-5-propoxy-N-propylaniline
CasNumber: 1311197-83-7
MolecularFormula: C12H17BrN2O3
MolecularWeight: 317.179
MdlNumber: MFCD19237157
Smiles: CCCNc1cc(OCCC)c(cc1[N+](=O)[O-])Br
Complexity: 260
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 6
Xlogp3: 4.7
CatalogNumber:
AA40696
ChemicalName:
4-Bromo-2-nitro-5-propoxy-N-propylaniline
CasNumber:
1311197-83-7
MolecularFormula:
C12H17BrN2O3
MolecularWeight:
317.179
MdlNumber:
MFCD19237157
Smiles:
CCCNc1cc(OCCC)c(cc1[N+](=O)[O-])Br
Complexity:
260
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
6
Xlogp3:
4.7
CatalogNumber: AA40697
ChemicalName: 5-Iodo-1-(tetrahydropyran-2-yl)pyrazole
CasNumber: 1311197-82-6
MolecularFormula: C8H11IN2O
MolecularWeight: 278.0902
MdlNumber: MFCD19237232
Smiles: Ic1ccnn1C1CCCCO1
Complexity: 156
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 1.7
CatalogNumber:
AA40697
ChemicalName:
5-Iodo-1-(tetrahydropyran-2-yl)pyrazole
CasNumber:
1311197-82-6
MolecularFormula:
C8H11IN2O
MolecularWeight:
278.0902
MdlNumber:
MFCD19237232
Smiles:
Ic1ccnn1C1CCCCO1
Complexity:
156
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Cc1nc2ccccc2cc1C(=O)c1ccc(cc1)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1nc2ccccc2cc1C(=O)c1ccc(cc1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Cc1ccc2c(c1Br)ccs2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1ccc2c(c1Br)ccs2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__