AB70553
827-36-1 | 2-(Dimethylamino)-2-phenylacetonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB70553
ChemicalName
2-(Dimethylamino)-2-phenylacetonitrile
CasNumber
827-36-1
MolecularFormula
C10H12N2
MolecularWeight
160.2157
MdlNumber
MFCD00013810
Smiles
CN(C(c1ccccc1)C#N)C
NscNumber
37416
Complexity
172
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
1.7
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CatalogNumber: AB70553
ChemicalName: 2-(Dimethylamino)-2-phenylacetonitrile
CasNumber: 827-36-1
MolecularFormula: C10H12N2
MolecularWeight: 160.2157
MdlNumber: MFCD00013810
Smiles: CN(C(c1ccccc1)C#N)C
NscNumber: 37416
Complexity: 172
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.7
CatalogNumber:
AB70553
ChemicalName:
2-(Dimethylamino)-2-phenylacetonitrile
CasNumber:
827-36-1
MolecularFormula:
C10H12N2
MolecularWeight:
160.2157
MdlNumber:
MFCD00013810
Smiles:
CN(C(c1ccccc1)C#N)C
NscNumber:
37416
Complexity:
172
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C(c1ccccc1)Sc1ccccc1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C(c1ccccc1)Sc1ccccc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB70555
ChemicalName: 2-Hydroxybenzotrifluoride
CasNumber: 444-30-4
MolecularFormula: C7H5F3O
MolecularWeight: 162.1092
MdlNumber: MFCD00002222
Smiles: Oc1ccccc1C(F)(F)F
NscNumber: 88333
Complexity: 132
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 2.8
CatalogNumber:
AB70555
ChemicalName:
2-Hydroxybenzotrifluoride
CasNumber:
444-30-4
MolecularFormula:
C7H5F3O
MolecularWeight:
162.1092
MdlNumber:
MFCD00002222
Smiles:
Oc1ccccc1C(F)(F)F
NscNumber:
88333
Complexity:
132
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCc1cc(Br)cc(c1O)Br
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCc1cc(Br)cc(c1O)Br
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__