AE04837
769-30-2 | 1,3-Benzodioxol-4-ylmethanol
Manufacturer: A2B Chem
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CatalogNumber
AE04837
ChemicalName
1,3-Benzodioxol-4-ylmethanol
CasNumber
769-30-2
MolecularFormula
C8H8O3
MolecularWeight
152.14731999999995
MdlNumber
MFCD02681980
Smiles
OCc1cccc2c1OCO2
Complexity
137
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.8
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CatalogNumber: AE04837
ChemicalName: 1,3-Benzodioxol-4-ylmethanol
CasNumber: 769-30-2
MolecularFormula: C8H8O3
MolecularWeight: 152.14731999999995
MdlNumber: MFCD02681980
Smiles: OCc1cccc2c1OCO2
Complexity: 137
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.8
CatalogNumber:
AE04837
ChemicalName:
1,3-Benzodioxol-4-ylmethanol
CasNumber:
769-30-2
MolecularFormula:
C8H8O3
MolecularWeight:
152.14731999999995
MdlNumber:
MFCD02681980
Smiles:
OCc1cccc2c1OCO2
Complexity:
137
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: COC(=O)c1c(C)n[nH]c1c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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MolecularWeight:
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Smiles:
COC(=O)c1c(C)n[nH]c1c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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__
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MolecularFormula: __
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Smiles: Nc1ccc2c(c1Br)ncs2
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Smiles:
Nc1ccc2c(c1Br)ncs2
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: O=CC(CC(F)(F)F)CC(F)(F)F
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HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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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=CC(CC(F)(F)F)CC(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__