AI52722
56766-24-6 | 2-Hydroxy-2-(4-methoxyphenyl)ethylamine, HCl
Manufacturer: A2B Chem
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CatalogNumber
AI52722
ChemicalName
2-Hydroxy-2-(4-methoxyphenyl)ethylamine, HCl
CasNumber
56766-24-6
MolecularFormula
C9H14ClNO2
MolecularWeight
203.666
MdlNumber
MFCD04117768
Smiles
NCC(c1ccc(cc1)OC)O.Cl
Complexity
122
Covalently-bondedUnitCount
2
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
3
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
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CatalogNumber: AI52722
ChemicalName: 2-Hydroxy-2-(4-methoxyphenyl)ethylamine, HCl
CasNumber: 56766-24-6
MolecularFormula: C9H14ClNO2
MolecularWeight: 203.666
MdlNumber: MFCD04117768
Smiles: NCC(c1ccc(cc1)OC)O.Cl
Complexity: 122
Covalently-bondedUnitCount: 2
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AI52722
ChemicalName:
2-Hydroxy-2-(4-methoxyphenyl)ethylamine, HCl
CasNumber:
56766-24-6
MolecularFormula:
C9H14ClNO2
MolecularWeight:
203.666
MdlNumber:
MFCD04117768
Smiles:
NCC(c1ccc(cc1)OC)O.Cl
Complexity:
122
Covalently-bondedUnitCount:
2
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: CCCCN(C(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])CCCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
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Smiles:
CCCCN(C(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])CCCC
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Smiles: OC(c1ccccc1Cl)CNC(C)(C)C.Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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MolecularFormula:
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Smiles:
OC(c1ccccc1Cl)CNC(C)(C)C.Cl
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Smiles: N#CCSCC(=O)N[C@]1(OC)C(=O)N2[C@@H]1SCC(=C2C(=O)[O-])CSc1nnnn1C.[Na+]
Complexity: 824
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
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:
__
Smiles:
N#CCSCC(=O)N[C@]1(OC)C(=O)N2[C@@H]1SCC(=C2C(=O)[O-])CSc1nnnn1C.[Na+]
Complexity:
824
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__