AF88306
325152-99-6 | (S)-2-Amino-2-(3-(trifluoromethyl)phenyl)ethanol hydrochloride
Manufacturer: A2B Chem
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CatalogNumber
AF88306
ChemicalName
(S)-2-Amino-2-(3-(trifluoromethyl)phenyl)ethanol hydrochloride
CasNumber
325152-99-6
MolecularFormula
C9H10F3NO
MolecularWeight
205.177
MdlNumber
MFCD09253706
Smiles
OC[C@H](c1cccc(c1)C(F)(F)F)N
Complexity
183
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
1
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CatalogNumber: AF88306
ChemicalName: (S)-2-Amino-2-(3-(trifluoromethyl)phenyl)ethanol hydrochloride
CasNumber: 325152-99-6
MolecularFormula: C9H10F3NO
MolecularWeight: 205.177
MdlNumber: MFCD09253706
Smiles: OC[C@H](c1cccc(c1)C(F)(F)F)N
Complexity: 183
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 1
CatalogNumber:
AF88306
ChemicalName:
(S)-2-Amino-2-(3-(trifluoromethyl)phenyl)ethanol hydrochloride
CasNumber:
325152-99-6
MolecularFormula:
C9H10F3NO
MolecularWeight:
205.177
MdlNumber:
MFCD09253706
Smiles:
OC[C@H](c1cccc(c1)C(F)(F)F)N
Complexity:
183
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
1
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MolecularFormula: __
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Smiles: O=c1[nH]ccc2c1cn[nH]2
Complexity: __
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Smiles:
O=c1[nH]ccc2c1cn[nH]2
Complexity:
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HeavyAtomCount:
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Smiles: Clc1cc(Cl)c2c(n1)ccc(c2)[N+](=O)[O-]
Complexity: __
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Smiles:
Clc1cc(Cl)c2c(n1)ccc(c2)[N+](=O)[O-]
Complexity:
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Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
__
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Smiles: N#Cc1cccc(c1[N+](=O)[O-])Cl
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#Cc1cccc(c1[N+](=O)[O-])Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__