AB55202
10351-19-6 | (4-Pyridylthio)acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AB55202
ChemicalName
(4-Pyridylthio)acetic acid
CasNumber
10351-19-6
MolecularFormula
C7H7NO2S
MolecularWeight
169.201
MdlNumber
MFCD00006424
Smiles
OC(=O)CSc1ccncc1
Complexity
134
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1
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CatalogNumber: AB55202
ChemicalName: (4-Pyridylthio)acetic acid
CasNumber: 10351-19-6
MolecularFormula: C7H7NO2S
MolecularWeight: 169.201
MdlNumber: MFCD00006424
Smiles: OC(=O)CSc1ccncc1
Complexity: 134
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1
CatalogNumber:
AB55202
ChemicalName:
(4-Pyridylthio)acetic acid
CasNumber:
10351-19-6
MolecularFormula:
C7H7NO2S
MolecularWeight:
169.201
MdlNumber:
MFCD00006424
Smiles:
OC(=O)CSc1ccncc1
Complexity:
134
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@@H]1CSC(=S)N1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@@H]1CSC(=S)N1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB55204
ChemicalName: (R)-4-Isopropyl-2-oxazolidinone
CasNumber: 95530-58-8
MolecularFormula: C6H11NO2
MolecularWeight: 129.157
MdlNumber: MFCD00075172
Smiles: CC([C@@H]1COC(=O)N1)C
Complexity: 122
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.1
CatalogNumber:
AB55204
ChemicalName:
(R)-4-Isopropyl-2-oxazolidinone
CasNumber:
95530-58-8
MolecularFormula:
C6H11NO2
MolecularWeight:
129.157
MdlNumber:
MFCD00075172
Smiles:
CC([C@@H]1COC(=O)N1)C
Complexity:
122
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@]1(C)CCC[C@]2([C@H]1CC[C@]13[C@@H]2CC[C@](C3)(C(=C)C1)O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@]1(C)CCC[C@]2([C@H]1CC[C@]13[C@@H]2CC[C@](C3)(C(=C)C1)O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__