AB22704
23308-82-9 | 1-(3-Methoxyphenyl)ethanol
Manufacturer: A2B Chem
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CatalogNumber
AB22704
ChemicalName
1-(3-Methoxyphenyl)ethanol
CasNumber
23308-82-9
MolecularFormula
C9H12O2
MolecularWeight
152.1904
MdlNumber
MFCD00021866
Smiles
COc1cccc(c1)C(O)C
NscNumber
143364
Complexity
114
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
1.8
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CatalogNumber: AB22704
ChemicalName: 1-(3-Methoxyphenyl)ethanol
CasNumber: 23308-82-9
MolecularFormula: C9H12O2
MolecularWeight: 152.1904
MdlNumber: MFCD00021866
Smiles: COc1cccc(c1)C(O)C
NscNumber: 143364
Complexity: 114
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.8
CatalogNumber:
AB22704
ChemicalName:
1-(3-Methoxyphenyl)ethanol
CasNumber:
23308-82-9
MolecularFormula:
C9H12O2
MolecularWeight:
152.1904
MdlNumber:
MFCD00021866
Smiles:
COc1cccc(c1)C(O)C
NscNumber:
143364
Complexity:
114
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.8
CatalogNumber: __
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MolecularFormula: __
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Smiles: CCN(c1ccc(cc1)C(c1ccc(cc1)N(CC)CC)(c1ccccc1)c1ccccc1)CC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
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HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
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Smiles:
CCN(c1ccc(cc1)C(c1ccc(cc1)N(CC)CC)(c1ccccc1)c1ccccc1)CC
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Complexity:
__
Covalently-bondedUnitCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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Smiles: Nc1ccc(cc1)S(=O)(=O)Nc1cncc(n1)Cl.[Na]
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Complexity: __
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Smiles:
Nc1ccc(cc1)S(=O)(=O)Nc1cncc(n1)Cl.[Na]
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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MolecularFormula: __
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Smiles: CCS(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])N
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCS(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])N
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__