AF68195
3733-29-7 | 5,5-Bis(bromomethyl)-2-phenyl-1,3-dioxane
Manufacturer: A2B Chem
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CatalogNumber
AF68195
ChemicalName
5,5-Bis(bromomethyl)-2-phenyl-1,3-dioxane
CasNumber
3733-29-7
MolecularFormula
C12H14Br2O2
MolecularWeight
350.0464
MdlNumber
MFCD09867296
Smiles
BrCC1(CBr)COC(OC1)c1ccccc1
Complexity
203
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
RotatableBondCount
3
Xlogp3
3
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CatalogNumber: AF68195
ChemicalName: 5,5-Bis(bromomethyl)-2-phenyl-1,3-dioxane
CasNumber: 3733-29-7
MolecularFormula: C12H14Br2O2
MolecularWeight: 350.0464
MdlNumber: MFCD09867296
Smiles: BrCC1(CBr)COC(OC1)c1ccccc1
Complexity: 203
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 3
CatalogNumber:
AF68195
ChemicalName:
5,5-Bis(bromomethyl)-2-phenyl-1,3-dioxane
CasNumber:
3733-29-7
MolecularFormula:
C12H14Br2O2
MolecularWeight:
350.0464
MdlNumber:
MFCD09867296
Smiles:
BrCC1(CBr)COC(OC1)c1ccccc1
Complexity:
203
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc2c(c1)CNCCC2=O.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc2c(c1)CNCCC2=O.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(c1cc2c(c(c1O)Cl)C(C)(C)CCC2(C)C)Nc1cc(F)c(c(c1)F)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1cc2c(c(c1O)Cl)C(C)(C)CCC2(C)C)Nc1cc(F)c(c(c1)F)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF68198
ChemicalName: 2-Chloro-3-nitroaniline
CasNumber: 3970-41-0
MolecularFormula: C6H5ClN2O2
MolecularWeight: 172.5691
MdlNumber: MFCD00800473
Smiles: [O-][N+](=O)c1cccc(c1Cl)N
Complexity: 159
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: __
Xlogp3: 1.7
CatalogNumber:
AF68198
ChemicalName:
2-Chloro-3-nitroaniline
CasNumber:
3970-41-0
MolecularFormula:
C6H5ClN2O2
MolecularWeight:
172.5691
MdlNumber:
MFCD00800473
Smiles:
[O-][N+](=O)c1cccc(c1Cl)N
Complexity:
159
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
__
Xlogp3:
1.7