AA96225
180869-38-9 | 2-(Methylamino)pyrimidine-4-carboxaldehyde dimethyl acetal
Manufacturer: A2B Chem
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CatalogNumber
AA96225
ChemicalName
2-(Methylamino)pyrimidine-4-carboxaldehyde dimethyl acetal
CasNumber
180869-38-9
MolecularFormula
C8H13N3O2
MolecularWeight
183.2077
MdlNumber
MFCD10566061
Smiles
COC(c1ccnc(n1)NC)OC
Complexity
141
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
0.2
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CatalogNumber: AA96225
ChemicalName: 2-(Methylamino)pyrimidine-4-carboxaldehyde dimethyl acetal
CasNumber: 180869-38-9
MolecularFormula: C8H13N3O2
MolecularWeight: 183.2077
MdlNumber: MFCD10566061
Smiles: COC(c1ccnc(n1)NC)OC
Complexity: 141
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 0.2
CatalogNumber:
AA96225
ChemicalName:
2-(Methylamino)pyrimidine-4-carboxaldehyde dimethyl acetal
CasNumber:
180869-38-9
MolecularFormula:
C8H13N3O2
MolecularWeight:
183.2077
MdlNumber:
MFCD10566061
Smiles:
COC(c1ccnc(n1)NC)OC
Complexity:
141
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
0.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(c1ccnc(n1)SC)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(c1ccnc(n1)SC)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)C(=O)c1cccc(c1Cl)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)C(=O)c1cccc(c1Cl)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA96229
ChemicalName: Methyl 3-(N-Boc-aminomethyl)benzoate
CasNumber: 180863-55-2
MolecularFormula: C14H19NO4
MolecularWeight: 265.305
MdlNumber: MFCD14583094
Smiles: COC(=O)c1cccc(c1)CNC(=O)OC(C)(C)C
Complexity: 322
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 6
Xlogp3: 2.3
CatalogNumber:
AA96229
ChemicalName:
Methyl 3-(N-Boc-aminomethyl)benzoate
CasNumber:
180863-55-2
MolecularFormula:
C14H19NO4
MolecularWeight:
265.305
MdlNumber:
MFCD14583094
Smiles:
COC(=O)c1cccc(c1)CNC(=O)OC(C)(C)C
Complexity:
322
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
6
Xlogp3:
2.3