AB50191
349-95-1 | 4-Hydroxymethylbenzotrifluoride
Manufacturer: A2B Chem
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CatalogNumber
AB50191
ChemicalName
4-Hydroxymethylbenzotrifluoride
CasNumber
349-95-1
MolecularFormula
C8H7F3O
MolecularWeight
176.1358
MdlNumber
MFCD00004661
Smiles
OCc1ccc(cc1)C(F)(F)F
Complexity
136
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AB50191
ChemicalName: 4-Hydroxymethylbenzotrifluoride
CasNumber: 349-95-1
MolecularFormula: C8H7F3O
MolecularWeight: 176.1358
MdlNumber: MFCD00004661
Smiles: OCc1ccc(cc1)C(F)(F)F
Complexity: 136
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AB50191
ChemicalName:
4-Hydroxymethylbenzotrifluoride
CasNumber:
349-95-1
MolecularFormula:
C8H7F3O
MolecularWeight:
176.1358
MdlNumber:
MFCD00004661
Smiles:
OCc1ccc(cc1)C(F)(F)F
Complexity:
136
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCC1(C)OCCO1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCC1(C)OCCO1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB50193
ChemicalName: 2-Methylpyrimidine-5-boronic acid
CasNumber: 1034924-06-5
MolecularFormula: C5H7BN2O2
MolecularWeight: 137.9323
MdlNumber: MFCD07375144
Smiles: OB(c1cnc(nc1)C)O
Complexity: 104
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB50193
ChemicalName:
2-Methylpyrimidine-5-boronic acid
CasNumber:
1034924-06-5
MolecularFormula:
C5H7BN2O2
MolecularWeight:
137.9323
MdlNumber:
MFCD07375144
Smiles:
OB(c1cnc(nc1)C)O
Complexity:
104
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1nnc(c(c1)Br)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1nnc(c(c1)Br)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__