AB55418
52950-18-2 | (R)-(-)-2-Chloromandelic acid
Manufacturer: A2B Chem
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CatalogNumber
AB55418
ChemicalName
(R)-(-)-2-Chloromandelic acid
CasNumber
52950-18-2
MolecularFormula
C8H7ClO3
MolecularWeight
186.5924
MdlNumber
MFCD00798429
Smiles
OC(=O)[C@@H](c1ccccc1Cl)O
Complexity
172
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
1.5
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CatalogNumber: AB55418
ChemicalName: (R)-(-)-2-Chloromandelic acid
CasNumber: 52950-18-2
MolecularFormula: C8H7ClO3
MolecularWeight: 186.5924
MdlNumber: MFCD00798429
Smiles: OC(=O)[C@@H](c1ccccc1Cl)O
Complexity: 172
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 1.5
CatalogNumber:
AB55418
ChemicalName:
(R)-(-)-2-Chloromandelic acid
CasNumber:
52950-18-2
MolecularFormula:
C8H7ClO3
MolecularWeight:
186.5924
MdlNumber:
MFCD00798429
Smiles:
OC(=O)[C@@H](c1ccccc1Cl)O
Complexity:
172
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
1.5
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RotatableBondCount:
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MolecularFormula: __
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Smiles: C[C@@H](N=C=S)CCCCC
Complexity: __
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DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C[C@@H](N=C=S)CCCCC
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@@](c1ccccc1)(O)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@@](c1ccccc1)(O)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__