AE25124
1158452-11-9 | N-(4-Nitrobenzyl)ethanamine HCl
Manufacturer: A2B Chem
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CatalogNumber
AE25124
ChemicalName
N-(4-Nitrobenzyl)ethanamine HCl
CasNumber
1158452-11-9
MolecularFormula
C9H13ClN2O2
MolecularWeight
216.6647
MdlNumber
MFCD07109772
Smiles
CCNCc1ccc(cc1)[N+](=O)[O-].Cl
Complexity
160
Covalently-bondedUnitCount
2
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
3
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CatalogNumber: AE25124
ChemicalName: N-(4-Nitrobenzyl)ethanamine HCl
CasNumber: 1158452-11-9
MolecularFormula: C9H13ClN2O2
MolecularWeight: 216.6647
MdlNumber: MFCD07109772
Smiles: CCNCc1ccc(cc1)[N+](=O)[O-].Cl
Complexity: 160
Covalently-bondedUnitCount: 2
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AE25124
ChemicalName:
N-(4-Nitrobenzyl)ethanamine HCl
CasNumber:
1158452-11-9
MolecularFormula:
C9H13ClN2O2
MolecularWeight:
216.6647
MdlNumber:
MFCD07109772
Smiles:
CCNCc1ccc(cc1)[N+](=O)[O-].Cl
Complexity:
160
Covalently-bondedUnitCount:
2
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: AE25125
ChemicalName: 1-Cyclopentyl-4-iodo-1H-pyrazole
CasNumber: 1194377-14-4
MolecularFormula: C8H11IN2
MolecularWeight: 262.0908
MdlNumber: MFCD13176539
Smiles: Ic1cnn(c1)C1CCCC1
Complexity: 134
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: 1
CatalogNumber:
AE25125
ChemicalName:
1-Cyclopentyl-4-iodo-1H-pyrazole
CasNumber:
1194377-14-4
MolecularFormula:
C8H11IN2
MolecularWeight:
262.0908
MdlNumber:
MFCD13176539
Smiles:
Ic1cnn(c1)C1CCCC1
Complexity:
134
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
1
CatalogNumber: AE25126
ChemicalName: tert-Butyl 5-bromo-2H,3H-pyrrolo[2,3-b]pyridine-1-carboxylate
CasNumber: 1111638-13-1
MolecularFormula: C12H15BrN2O2
MolecularWeight: 299.1637
MdlNumber: MFCD24448794
Smiles: Brc1cnc2c(c1)CCN2C(=O)OC(C)(C)C
Complexity: 303
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 2
CatalogNumber:
AE25126
ChemicalName:
tert-Butyl 5-bromo-2H,3H-pyrrolo[2,3-b]pyridine-1-carboxylate
CasNumber:
1111638-13-1
MolecularFormula:
C12H15BrN2O2
MolecularWeight:
299.1637
MdlNumber:
MFCD24448794
Smiles:
Brc1cnc2c(c1)CCN2C(=O)OC(C)(C)C
Complexity:
303
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCN1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]
Complexity: 264
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCN1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]
Complexity:
264
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__