AB67406
13431-34-0 | 4-Ethyl-3-thiosemicarbazide
Manufacturer: A2B Chem
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CatalogNumber
AB67406
ChemicalName
4-Ethyl-3-thiosemicarbazide
CasNumber
13431-34-0
MolecularFormula
C3H9N3S
MolecularWeight
119.18865999999998
MdlNumber
MFCD00007618
Smiles
CCNC(=S)NN
NscNumber
84217
Complexity
63.2
Covalently-bondedUnitCount
1
HeavyAtomCount
7
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
3
RotatableBondCount
1
Xlogp3
-0.4
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CatalogNumber: AB67406
ChemicalName: 4-Ethyl-3-thiosemicarbazide
CasNumber: 13431-34-0
MolecularFormula: C3H9N3S
MolecularWeight: 119.18865999999998
MdlNumber: MFCD00007618
Smiles: CCNC(=S)NN
NscNumber: 84217
Complexity: 63.2
Covalently-bondedUnitCount: 1
HeavyAtomCount: 7
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 3
RotatableBondCount: 1
Xlogp3: -0.4
CatalogNumber:
AB67406
ChemicalName:
4-Ethyl-3-thiosemicarbazide
CasNumber:
13431-34-0
MolecularFormula:
C3H9N3S
MolecularWeight:
119.18865999999998
MdlNumber:
MFCD00007618
Smiles:
CCNC(=S)NN
NscNumber:
84217
Complexity:
63.2
Covalently-bondedUnitCount:
1
HeavyAtomCount:
7
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
3
RotatableBondCount:
1
Xlogp3:
-0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)c1ccc(cc1)CC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)c1ccc(cc1)CC
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC1(C)CC(=O)NC(=O)C1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCC1(C)CC(=O)NC(=O)C1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB67409
ChemicalName: 4-Ethylamino-1-butanol
CasNumber: 39216-86-9
MolecularFormula: C6H15NO
MolecularWeight: 117.1894
MdlNumber: MFCD00671534
Smiles: OCCCCNCC
NscNumber: __
Complexity: 39.5
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 5
Xlogp3: 0.2
CatalogNumber:
AB67409
ChemicalName:
4-Ethylamino-1-butanol
CasNumber:
39216-86-9
MolecularFormula:
C6H15NO
MolecularWeight:
117.1894
MdlNumber:
MFCD00671534
Smiles:
OCCCCNCC
NscNumber:
__
Complexity:
39.5
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
5
Xlogp3:
0.2