AA85538
163487-10-3 | Methyl (E)-3-(3-aminophenyl)acrylate
Manufacturer: A2B Chem
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CatalogNumber
AA85538
ChemicalName
Methyl (E)-3-(3-aminophenyl)acrylate
CasNumber
163487-10-3
MolecularFormula
C10H11NO2
MolecularWeight
177.1998
MdlNumber
MFCD20527968
Smiles
COC(=O)/C=C/c1cccc(c1)N
Complexity
201
Covalently-bondedUnitCount
1
DefinedBondStereocenterCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.5
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CatalogNumber: AA85538
ChemicalName: Methyl (E)-3-(3-aminophenyl)acrylate
CasNumber: 163487-10-3
MolecularFormula: C10H11NO2
MolecularWeight: 177.1998
MdlNumber: MFCD20527968
Smiles: COC(=O)/C=C/c1cccc(c1)N
Complexity: 201
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.5
CatalogNumber:
AA85538
ChemicalName:
Methyl (E)-3-(3-aminophenyl)acrylate
CasNumber:
163487-10-3
MolecularFormula:
C10H11NO2
MolecularWeight:
177.1998
MdlNumber:
MFCD20527968
Smiles:
COC(=O)/C=C/c1cccc(c1)N
Complexity:
201
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.5
CatalogNumber: AA85539
ChemicalName: 8-Bromo-2-chloroquinoline
CasNumber: 163485-86-7
MolecularFormula: C9H5BrClN
MolecularWeight: 242.4997
MdlNumber: MFCD08741410
Smiles: Clc1ccc2c(n1)c(Br)ccc2
Complexity: 165
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: __
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.8
CatalogNumber:
AA85539
ChemicalName:
8-Bromo-2-chloroquinoline
CasNumber:
163485-86-7
MolecularFormula:
C9H5BrClN
MolecularWeight:
242.4997
MdlNumber:
MFCD08741410
Smiles:
Clc1ccc2c(n1)c(Br)ccc2
Complexity:
165
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
__
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.8
CatalogNumber: AA85542
ChemicalName: 2-Aminobenzamide oxime
CasNumber: 16348-49-5
MolecularFormula: C7H9N3O
MolecularWeight: 151.1659
MdlNumber: MFCD00492723
Smiles: ONC(=N)c1ccccc1N
Complexity: 158
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 1
Xlogp3: 0.6
CatalogNumber:
AA85542
ChemicalName:
2-Aminobenzamide oxime
CasNumber:
16348-49-5
MolecularFormula:
C7H9N3O
MolecularWeight:
151.1659
MdlNumber:
MFCD00492723
Smiles:
ONC(=N)c1ccccc1N
Complexity:
158
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
1
Xlogp3:
0.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccccc1N1C(=O)CC(=O)NC1=O
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccccc1N1C(=O)CC(=O)NC1=O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__