AB49182
625-51-4 | N-(Hydroxymethyl)acetamide
Manufacturer: A2B Chem
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CatalogNumber
AB49182
ChemicalName
N-(Hydroxymethyl)acetamide
CasNumber
625-51-4
MolecularFormula
C3H7NO2
MolecularWeight
89.0932
MdlNumber
MFCD00014417
Smiles
CC(=O)NCO
Complexity
52.8
Covalently-bondedUnitCount
1
HeavyAtomCount
6
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
-1
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CatalogNumber: AB49182
ChemicalName: N-(Hydroxymethyl)acetamide
CasNumber: 625-51-4
MolecularFormula: C3H7NO2
MolecularWeight: 89.0932
MdlNumber: MFCD00014417
Smiles: CC(=O)NCO
Complexity: 52.8
Covalently-bondedUnitCount: 1
HeavyAtomCount: 6
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: -1
CatalogNumber:
AB49182
ChemicalName:
N-(Hydroxymethyl)acetamide
CasNumber:
625-51-4
MolecularFormula:
C3H7NO2
MolecularWeight:
89.0932
MdlNumber:
MFCD00014417
Smiles:
CC(=O)NCO
Complexity:
52.8
Covalently-bondedUnitCount:
1
HeavyAtomCount:
6
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
-1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1N[C@@H](Cc2c[nH]c3c2cccc3)C(=O)N2[C@H]1CCC2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1N[C@@H](Cc2c[nH]c3c2cccc3)C(=O)N2[C@H]1CCC2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB49184
ChemicalName: 1-Boc-3-(Methylamino)piperidine
CasNumber: 392331-89-4
MolecularFormula: C11H22N2O2
MolecularWeight: 214.3046
MdlNumber: MFCD04114980
Smiles: CNC1CCCN(C1)C(=O)OC(C)(C)C
Complexity: 223
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.2
CatalogNumber:
AB49184
ChemicalName:
1-Boc-3-(Methylamino)piperidine
CasNumber:
392331-89-4
MolecularFormula:
C11H22N2O2
MolecularWeight:
214.3046
MdlNumber:
MFCD04114980
Smiles:
CNC1CCCN(C1)C(=O)OC(C)(C)C
Complexity:
223
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.2
CatalogNumber: AB49185
ChemicalName: 2-Chloro-3-(trifluoromethyl)benzoic acid
CasNumber: 39226-97-6
MolecularFormula: C8H4ClF3O2
MolecularWeight: 224.5644
MdlNumber: MFCD00792415
Smiles: OC(=O)c1cccc(c1Cl)C(F)(F)F
Complexity: 229
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3
CatalogNumber:
AB49185
ChemicalName:
2-Chloro-3-(trifluoromethyl)benzoic acid
CasNumber:
39226-97-6
MolecularFormula:
C8H4ClF3O2
MolecularWeight:
224.5644
MdlNumber:
MFCD00792415
Smiles:
OC(=O)c1cccc(c1Cl)C(F)(F)F
Complexity:
229
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3