AB04378
203186-56-5 | Methyl 2-acetyl-3-(dimethylamino)acrylate
Manufacturer: A2B Chem
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CatalogNumber
AB04378
ChemicalName
Methyl 2-acetyl-3-(dimethylamino)acrylate
CasNumber
203186-56-5
MolecularFormula
C8H13NO3
MolecularWeight
171.1937
MdlNumber
MFCD08689663
Smiles
COC(=O)/C(=C/N(C)C)/C(=O)C
Complexity
218
Covalently-bondedUnitCount
1
DefinedBondStereocenterCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
RotatableBondCount
4
Xlogp3
0.4
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CatalogNumber: AB04378
ChemicalName: Methyl 2-acetyl-3-(dimethylamino)acrylate
CasNumber: 203186-56-5
MolecularFormula: C8H13NO3
MolecularWeight: 171.1937
MdlNumber: MFCD08689663
Smiles: COC(=O)/C(=C/N(C)C)/C(=O)C
Complexity: 218
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 0.4
CatalogNumber:
AB04378
ChemicalName:
Methyl 2-acetyl-3-(dimethylamino)acrylate
CasNumber:
203186-56-5
MolecularFormula:
C8H13NO3
MolecularWeight:
171.1937
MdlNumber:
MFCD08689663
Smiles:
COC(=O)/C(=C/N(C)C)/C(=O)C
Complexity:
218
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(c1ccc(cc1)Br)C1CCN(CC1)C(=O)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1ccc(cc1)Br)C1CCN(CC1)C(=O)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB04380
ChemicalName: 3-Cyano-4-nitrobenzaldehyde
CasNumber: 203179-02-6
MolecularFormula: C8H4N2O3
MolecularWeight: 176.129
MdlNumber: MFCD28968079
Smiles: N#Cc1cc(C=O)ccc1[N+](=O)[O-]
Complexity: 262
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: __
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 1
CatalogNumber:
AB04380
ChemicalName:
3-Cyano-4-nitrobenzaldehyde
CasNumber:
203179-02-6
MolecularFormula:
C8H4N2O3
MolecularWeight:
176.129
MdlNumber:
MFCD28968079
Smiles:
N#Cc1cc(C=O)ccc1[N+](=O)[O-]
Complexity:
262
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
__
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: FC([C@@H]1OC[C@H](N1)c1ccccc1)(F)F
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
FC([C@@H]1OC[C@H](N1)c1ccccc1)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__