AI43649
1951425-23-2 | (2S)-2-Amino-2-(3-fluoro-2-methylphenyl)ethan-1-ol hcl
Manufacturer: A2B Chem
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CatalogNumber
AI43649
ChemicalName
(2S)-2-Amino-2-(3-fluoro-2-methylphenyl)ethan-1-ol hcl
CasNumber
1951425-23-2
MolecularFormula
C9H13ClFNO
MolecularWeight
205.657
MdlNumber
MFCD24417001
Smiles
Cc1c([C@@H](CO)N)cccc1F.Cl
Complexity
143
Covalently-bondedUnitCount
2
DefinedAtomStereocenterCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
3
RotatableBondCount
2
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CatalogNumber: AI43649
ChemicalName: (2S)-2-Amino-2-(3-fluoro-2-methylphenyl)ethan-1-ol hcl
CasNumber: 1951425-23-2
MolecularFormula: C9H13ClFNO
MolecularWeight: 205.657
MdlNumber: MFCD24417001
Smiles: Cc1c([C@@H](CO)N)cccc1F.Cl
Complexity: 143
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 2
CatalogNumber:
AI43649
ChemicalName:
(2S)-2-Amino-2-(3-fluoro-2-methylphenyl)ethan-1-ol hcl
CasNumber:
1951425-23-2
MolecularFormula:
C9H13ClFNO
MolecularWeight:
205.657
MdlNumber:
MFCD24417001
Smiles:
Cc1c([C@@H](CO)N)cccc1F.Cl
Complexity:
143
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
2
CatalogNumber: __
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Smiles: Clc1ccc(c(c1)Cl)CN1CC[C@H](C1=O)N
Complexity: __
Covalently-bondedUnitCount: __
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Smiles:
Clc1ccc(c(c1)Cl)CN1CC[C@H](C1=O)N
Complexity:
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Smiles: COc1cc(OC)ccc1CN1CC[C@@H](C1=O)N.Cl
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
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Smiles:
COc1cc(OC)ccc1CN1CC[C@@H](C1=O)N.Cl
Complexity:
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DefinedAtomStereocenterCount:
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HeavyAtomCount:
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HydrogenBondDonorCount:
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Smiles: O=NN(CCC/C(=N/NC(=O)CCCC[C@@H]1CCC2C1NC(=O)CN2)/c1cccnc1)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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:
O=NN(CCC/C(=N/NC(=O)CCCC[C@@H]1CCC2C1NC(=O)CN2)/c1cccnc1)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__