AB50874
63666-11-5 | Ethyl 5-amino-4H-[1,2,4]triazole-3-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB50874
ChemicalName
Ethyl 5-amino-4H-[1,2,4]triazole-3-carboxylate
CasNumber
63666-11-5
MolecularFormula
C5H8N4O2
MolecularWeight
156.1426
MdlNumber
MFCD00186115
Smiles
CCOC(=O)c1nnc([nH]1)N
NscNumber
148474
Complexity
151
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
0.2
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CatalogNumber: AB50874
ChemicalName: Ethyl 5-amino-4H-[1,2,4]triazole-3-carboxylate
CasNumber: 63666-11-5
MolecularFormula: C5H8N4O2
MolecularWeight: 156.1426
MdlNumber: MFCD00186115
Smiles: CCOC(=O)c1nnc([nH]1)N
NscNumber: 148474
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 0.2
CatalogNumber:
AB50874
ChemicalName:
Ethyl 5-amino-4H-[1,2,4]triazole-3-carboxylate
CasNumber:
63666-11-5
MolecularFormula:
C5H8N4O2
MolecularWeight:
156.1426
MdlNumber:
MFCD00186115
Smiles:
CCOC(=O)c1nnc([nH]1)N
NscNumber:
148474
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
0.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC(C(=O)O)CC(=O)O
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCC(C(=O)O)CC(=O)O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB50876
ChemicalName: 4-((Tetrahydrofuran-2-yl)oxy)butan-1-ol
CasNumber: 64001-06-5
MolecularFormula: C8H16O3
MolecularWeight: 160.2108
MdlNumber: MFCD18976725
Smiles: OCCCCOC1CCCO1
NscNumber: __
Complexity: 95.3
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 0.6
CatalogNumber:
AB50876
ChemicalName:
4-((Tetrahydrofuran-2-yl)oxy)butan-1-ol
CasNumber:
64001-06-5
MolecularFormula:
C8H16O3
MolecularWeight:
160.2108
MdlNumber:
MFCD18976725
Smiles:
OCCCCOC1CCCO1
NscNumber:
__
Complexity:
95.3
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
0.6
CatalogNumber: AB50877
ChemicalName: 3-Bromopropionamide
CasNumber: 6320-96-3
MolecularFormula: C3H6BrNO
MolecularWeight: 151.9898
MdlNumber: MFCD00143100
Smiles: NC(=O)CCBr
NscNumber: 32255
Complexity: 54.8
Covalently-bondedUnitCount: 1
HeavyAtomCount: 6
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: -0.2
CatalogNumber:
AB50877
ChemicalName:
3-Bromopropionamide
CasNumber:
6320-96-3
MolecularFormula:
C3H6BrNO
MolecularWeight:
151.9898
MdlNumber:
MFCD00143100
Smiles:
NC(=O)CCBr
NscNumber:
32255
Complexity:
54.8
Covalently-bondedUnitCount:
1
HeavyAtomCount:
6
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
-0.2