AI44622
2044705-93-1 | (2S)-2-Amino-2-(3,5-difluorophenyl)ethan-1-ol hydrochloride
Manufacturer: A2B Chem
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CatalogNumber
AI44622
ChemicalName
(2S)-2-Amino-2-(3,5-difluorophenyl)ethan-1-ol hydrochloride
CasNumber
2044705-93-1
MolecularFormula
C8H10ClF2NO
MolecularWeight
209.6209
MdlNumber
MFCD24414217
Smiles
OCC(c1cc(F)cc(c1)F)N.Cl
Complexity
135
Covalently-bondedUnitCount
2
DefinedAtomStereocenterCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
2
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CatalogNumber: AI44622
ChemicalName: (2S)-2-Amino-2-(3,5-difluorophenyl)ethan-1-ol hydrochloride
CasNumber: 2044705-93-1
MolecularFormula: C8H10ClF2NO
MolecularWeight: 209.6209
MdlNumber: MFCD24414217
Smiles: OCC(c1cc(F)cc(c1)F)N.Cl
Complexity: 135
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 2
CatalogNumber:
AI44622
ChemicalName:
(2S)-2-Amino-2-(3,5-difluorophenyl)ethan-1-ol hydrochloride
CasNumber:
2044705-93-1
MolecularFormula:
C8H10ClF2NO
MolecularWeight:
209.6209
MdlNumber:
MFCD24414217
Smiles:
OCC(c1cc(F)cc(c1)F)N.Cl
Complexity:
135
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
2
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Smiles: CCCNC(=O)C(c1ccccc1)c1ccccc1
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Smiles:
CCCNC(=O)C(c1ccccc1)c1ccccc1
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Smiles: CCCSC1=C(C=C(C=N1)C(F)(F)F)Cl
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Smiles:
CCCSC1=C(C=C(C=N1)C(F)(F)F)Cl
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Smiles: N#CCCOP(N(C(C)C)C(C)C)OCCCCCCNC(=O)c1ccc2c(c1)C1(OC2=O)c2ccc(cc2Oc2c1ccc(c2)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C
Complexity: __
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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:
N#CCCOP(N(C(C)C)C(C)C)OCCCCCCNC(=O)c1ccc2c(c1)C1(OC2=O)c2ccc(cc2Oc2c1ccc(c2)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__