AI33627
1391506-22-1 | (2S)-2-Amino-2-(3-chloro-2-fluorophenyl)ethan-1-ol hcl
Manufacturer: A2B Chem
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CatalogNumber
AI33627
ChemicalName
(2S)-2-Amino-2-(3-chloro-2-fluorophenyl)ethan-1-ol hcl
CasNumber
1391506-22-1
MolecularFormula
C8H10Cl2FNO
MolecularWeight
226.0755
MdlNumber
MFCD12758365
Smiles
N[C@@H](c1cccc(c1F)Cl)CO.Cl
Complexity
147
Covalently-bondedUnitCount
2
DefinedAtomStereocenterCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
3
RotatableBondCount
2
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CatalogNumber: AI33627
ChemicalName: (2S)-2-Amino-2-(3-chloro-2-fluorophenyl)ethan-1-ol hcl
CasNumber: 1391506-22-1
MolecularFormula: C8H10Cl2FNO
MolecularWeight: 226.0755
MdlNumber: MFCD12758365
Smiles: N[C@@H](c1cccc(c1F)Cl)CO.Cl
Complexity: 147
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 2
CatalogNumber:
AI33627
ChemicalName:
(2S)-2-Amino-2-(3-chloro-2-fluorophenyl)ethan-1-ol hcl
CasNumber:
1391506-22-1
MolecularFormula:
C8H10Cl2FNO
MolecularWeight:
226.0755
MdlNumber:
MFCD12758365
Smiles:
N[C@@H](c1cccc(c1F)Cl)CO.Cl
Complexity:
147
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
2
CatalogNumber: __
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Smiles: Clc1ccc(cc1[C@H]1CCCN1)C(F)(F)F.Cl
Complexity: __
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Smiles:
Clc1ccc(cc1[C@H]1CCCN1)C(F)(F)F.Cl
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Smiles: CC1=CC(=CC(=C1)C(C(C2=CC(=CC(=C2)C)C)N)N)C.OP(=O)(O)O
Complexity: __
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Smiles:
CC1=CC(=CC(=C1)C(C(C2=CC(=CC(=C2)C)C)N)N)C.OP(=O)(O)O
Complexity:
__
Covalently-bondedUnitCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: CCN1C(C(CCC1=O)C(=O)O)C2=C(C=CC(=C2)OC)OC
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
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RotatableBondCount: __
CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCN1C(C(CCC1=O)C(=O)O)C2=C(C=CC(=C2)OC)OC
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__