AB75524
2533-69-9 | Methyl 2,2,2-trichloroacetimidate
Manufacturer: A2B Chem
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CatalogNumber
AB75524
ChemicalName
Methyl 2,2,2-trichloroacetimidate
CasNumber
2533-69-9
MolecularFormula
C3H4Cl3NO
MolecularWeight
176.42896000000002
MdlNumber
MFCD00001759
Smiles
COC(=N)C(Cl)(Cl)Cl
NscNumber
306728
Complexity
97.2
Covalently-bondedUnitCount
1
HeavyAtomCount
8
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AB75524
ChemicalName: Methyl 2,2,2-trichloroacetimidate
CasNumber: 2533-69-9
MolecularFormula: C3H4Cl3NO
MolecularWeight: 176.42896000000002
MdlNumber: MFCD00001759
Smiles: COC(=N)C(Cl)(Cl)Cl
NscNumber: 306728
Complexity: 97.2
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AB75524
ChemicalName:
Methyl 2,2,2-trichloroacetimidate
CasNumber:
2533-69-9
MolecularFormula:
C3H4Cl3NO
MolecularWeight:
176.42896000000002
MdlNumber:
MFCD00001759
Smiles:
COC(=N)C(Cl)(Cl)Cl
NscNumber:
306728
Complexity:
97.2
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.1
CatalogNumber: AB75525
ChemicalName: Hydroxypivalic acid methyl ester
CasNumber: 14002-80-3
MolecularFormula: C6H12O3
MolecularWeight: 132.1577
MdlNumber: MFCD00021840
Smiles: OCC(C(=O)OC)(C)C
NscNumber: __
Complexity: 107
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.3
CatalogNumber:
AB75525
ChemicalName:
Hydroxypivalic acid methyl ester
CasNumber:
14002-80-3
MolecularFormula:
C6H12O3
MolecularWeight:
132.1577
MdlNumber:
MFCD00021840
Smiles:
OCC(C(=O)OC)(C)C
NscNumber:
__
Complexity:
107
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)C(C(=O)C)(C)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)C(C(=O)C)(C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CS[C@H]1O[C@H](COC(=O)C)[C@H]([C@@H]([C@@H]1OC(=O)C)OC(=O)C)OC(=O)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CS[C@H]1O[C@H](COC(=O)C)[C@H]([C@@H]([C@@H]1OC(=O)C)OC(=O)C)OC(=O)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__