AF58800
39270-39-8 | 2,3-Dihydro-1,4-benzodioxin-6-ylmethanol
Manufacturer: A2B Chem
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CatalogNumber
AF58800
ChemicalName
2,3-Dihydro-1,4-benzodioxin-6-ylmethanol
CasNumber
39270-39-8
MolecularFormula
C9H10O3
MolecularWeight
166.1739
MdlNumber
MFCD01317581
Smiles
OCc1ccc2c(c1)OCCO2
Complexity
149
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1
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CatalogNumber: AF58800
ChemicalName: 2,3-Dihydro-1,4-benzodioxin-6-ylmethanol
CasNumber: 39270-39-8
MolecularFormula: C9H10O3
MolecularWeight: 166.1739
MdlNumber: MFCD01317581
Smiles: OCc1ccc2c(c1)OCCO2
Complexity: 149
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1
CatalogNumber:
AF58800
ChemicalName:
2,3-Dihydro-1,4-benzodioxin-6-ylmethanol
CasNumber:
39270-39-8
MolecularFormula:
C9H10O3
MolecularWeight:
166.1739
MdlNumber:
MFCD01317581
Smiles:
OCc1ccc2c(c1)OCCO2
Complexity:
149
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1O)CCC(=O)c1c(O)cc(cc1O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1O)CCC(=O)c1c(O)cc(cc1O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF58802
ChemicalName: 4-Chloro-2-methylbenzaldehyde
CasNumber: 40137-29-9
MolecularFormula: C8H7ClO
MolecularWeight: 154.5936
MdlNumber: MFCD02261735
Smiles: O=Cc1ccc(cc1C)Cl
Complexity: 124
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 2.6
CatalogNumber:
AF58802
ChemicalName:
4-Chloro-2-methylbenzaldehyde
CasNumber:
40137-29-9
MolecularFormula:
C8H7ClO
MolecularWeight:
154.5936
MdlNumber:
MFCD02261735
Smiles:
O=Cc1ccc(cc1C)Cl
Complexity:
124
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Oc1cc(O)c(c(c1)O)C(=O)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Oc1cc(O)c(c(c1)O)C(=O)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__