AA79445
157437-25-7 | 4-Hydroxymethyl-2,2-difluoro-1,3-benzodioxole
Manufacturer: A2B Chem
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CatalogNumber
AA79445
ChemicalName
4-Hydroxymethyl-2,2-difluoro-1,3-benzodioxole
CasNumber
157437-25-7
MolecularFormula
C8H6F2O3
MolecularWeight
188.1282
MdlNumber
MFCD06202698
Smiles
OCc1cccc2c1OC(O2)(F)F
Complexity
198
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.6
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CatalogNumber: AA79445
ChemicalName: 4-Hydroxymethyl-2,2-difluoro-1,3-benzodioxole
CasNumber: 157437-25-7
MolecularFormula: C8H6F2O3
MolecularWeight: 188.1282
MdlNumber: MFCD06202698
Smiles: OCc1cccc2c1OC(O2)(F)F
Complexity: 198
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.6
CatalogNumber:
AA79445
ChemicalName:
4-Hydroxymethyl-2,2-difluoro-1,3-benzodioxole
CasNumber:
157437-25-7
MolecularFormula:
C8H6F2O3
MolecularWeight:
188.1282
MdlNumber:
MFCD06202698
Smiles:
OCc1cccc2c1OC(O2)(F)F
Complexity:
198
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: CC(C(=O)O)Oc1ccc(cc1)Oc1cnc2c(n1)cc(cc2)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
CC(C(=O)O)Oc1ccc(cc1)Oc1cnc2c(n1)cc(cc2)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
__
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MolecularFormula: __
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Smiles: O=CCCc1ccccc1Cl
Complexity: __
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HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
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Smiles:
O=CCCc1ccccc1Cl
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: C[C@H](C(=O)O)N(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C[C@H](C(=O)O)N(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__