AA01007
504-33-6 | Dl-homocysteic acid
Manufacturer: A2B Chem
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CatalogNumber
AA01007
ChemicalName
Dl-homocysteic acid
CasNumber
504-33-6
MolecularFormula
C4H9NO5S
MolecularWeight
183.183
MdlNumber
MFCD00007536
Smiles
OC(=O)C(CCS(=O)(=O)O)N
Complexity
227
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
3
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
-3.6
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CatalogNumber: AA01007
ChemicalName: Dl-homocysteic acid
CasNumber: 504-33-6
MolecularFormula: C4H9NO5S
MolecularWeight: 183.183
MdlNumber: MFCD00007536
Smiles: OC(=O)C(CCS(=O)(=O)O)N
Complexity: 227
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 3
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: -3.6
CatalogNumber:
AA01007
ChemicalName:
Dl-homocysteic acid
CasNumber:
504-33-6
MolecularFormula:
C4H9NO5S
MolecularWeight:
183.183
MdlNumber:
MFCD00007536
Smiles:
OC(=O)C(CCS(=O)(=O)O)N
Complexity:
227
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
3
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
-3.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClC1=C(Cl)C(=C(C2C1C1CCC2C1)Cl)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
ClC1=C(Cl)C(=C(C2C1C1CCC2C1)Cl)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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CasNumber:
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MolecularFormula:
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MdlNumber:
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Smiles:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COP1(=O)OCC2C(O1)C[C@@H](O2)n1cc(I)c(=O)[nH]c1=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COP1(=O)OCC2C(O1)C[C@@H](O2)n1cc(I)c(=O)[nH]c1=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__