AB47459
3513-81-3 | 2-Methylene-1,3-propanediol
Manufacturer: A2B Chem
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CatalogNumber
AB47459
ChemicalName
2-Methylene-1,3-propanediol
CasNumber
3513-81-3
MolecularFormula
C4H8O2
MolecularWeight
88.1051
MdlNumber
MFCD00075162
Smiles
OCC(=C)CO
Complexity
43.5
Covalently-bondedUnitCount
1
HeavyAtomCount
6
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
-0.4
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CatalogNumber: AB47459
ChemicalName: 2-Methylene-1,3-propanediol
CasNumber: 3513-81-3
MolecularFormula: C4H8O2
MolecularWeight: 88.1051
MdlNumber: MFCD00075162
Smiles: OCC(=C)CO
Complexity: 43.5
Covalently-bondedUnitCount: 1
HeavyAtomCount: 6
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: -0.4
CatalogNumber:
AB47459
ChemicalName:
2-Methylene-1,3-propanediol
CasNumber:
3513-81-3
MolecularFormula:
C4H8O2
MolecularWeight:
88.1051
MdlNumber:
MFCD00075162
Smiles:
OCC(=C)CO
Complexity:
43.5
Covalently-bondedUnitCount:
1
HeavyAtomCount:
6
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
-0.4
CatalogNumber: AB47460
ChemicalName: 5'-Fluoro-2'-iodoacetophenone
CasNumber: 914225-70-0
MolecularFormula: C8H6FIO
MolecularWeight: 264.0355
MdlNumber: MFCD09033159
Smiles: Fc1ccc(c(c1)C(=O)C)I
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 2.4
CatalogNumber:
AB47460
ChemicalName:
5'-Fluoro-2'-iodoacetophenone
CasNumber:
914225-70-0
MolecularFormula:
C8H6FIO
MolecularWeight:
264.0355
MdlNumber:
MFCD09033159
Smiles:
Fc1ccc(c(c1)C(=O)C)I
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCc1cc(CBr)c(cc1CBr)CBr
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCc1cc(CBr)c(cc1CBr)CBr
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCCC=C
Complexity: 24.8
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCCC=C
Complexity:
24.8
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.1