AB47501
4021-50-5 | 4-Trifluoromethylthiobenzaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AB47501
ChemicalName
4-Trifluoromethylthiobenzaldehyde
CasNumber
4021-50-5
MolecularFormula
C8H5F3OS
MolecularWeight
206.1849
MdlNumber
MFCD00129191
Smiles
O=Cc1ccc(cc1)SC(F)(F)F
Complexity
173
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
RotatableBondCount
2
Xlogp3
3.1
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CatalogNumber: AB47501
ChemicalName: 4-Trifluoromethylthiobenzaldehyde
CasNumber: 4021-50-5
MolecularFormula: C8H5F3OS
MolecularWeight: 206.1849
MdlNumber: MFCD00129191
Smiles: O=Cc1ccc(cc1)SC(F)(F)F
Complexity: 173
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
Xlogp3: 3.1
CatalogNumber:
AB47501
ChemicalName:
4-Trifluoromethylthiobenzaldehyde
CasNumber:
4021-50-5
MolecularFormula:
C8H5F3OS
MolecularWeight:
206.1849
MdlNumber:
MFCD00129191
Smiles:
O=Cc1ccc(cc1)SC(F)(F)F
Complexity:
173
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
Xlogp3:
3.1
CatalogNumber: AB47502
ChemicalName: 1H-Indazole-3-carbaldehyde
CasNumber: 5235-10-9
MolecularFormula: C8H6N2O
MolecularWeight: 146.14604
MdlNumber: MFCD04972468
Smiles: O=Cc1n[nH]c2c1cccc2
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 1.3
CatalogNumber:
AB47502
ChemicalName:
1H-Indazole-3-carbaldehyde
CasNumber:
5235-10-9
MolecularFormula:
C8H6N2O
MolecularWeight:
146.14604
MdlNumber:
MFCD04972468
Smiles:
O=Cc1n[nH]c2c1cccc2
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
1.3
CatalogNumber: AB47503
ChemicalName: 3-Pyrrolidin-1-yl-propionic acid
CasNumber: 76234-38-3
MolecularFormula: C7H13NO2
MolecularWeight: 143.1836
MdlNumber: MFCD04114076
Smiles: OC(=O)CCN1CCCC1
Complexity: 119
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: -2
CatalogNumber:
AB47503
ChemicalName:
3-Pyrrolidin-1-yl-propionic acid
CasNumber:
76234-38-3
MolecularFormula:
C7H13NO2
MolecularWeight:
143.1836
MdlNumber:
MFCD04114076
Smiles:
OC(=O)CCN1CCCC1
Complexity:
119
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
-2
CatalogNumber: AB47504
ChemicalName: Boc-D-Dap-OH
CasNumber: 76387-70-7
MolecularFormula: C8H16N2O4
MolecularWeight: 204.2236
MdlNumber: MFCD01632072
Smiles: NC[C@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
RotatableBondCount: 5
Xlogp3: -2.7
CatalogNumber:
AB47504
ChemicalName:
Boc-D-Dap-OH
CasNumber:
76387-70-7
MolecularFormula:
C8H16N2O4
MolecularWeight:
204.2236
MdlNumber:
MFCD01632072
Smiles:
NC[C@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
RotatableBondCount:
5
Xlogp3:
-2.7