AB46074
37746-78-4 | (E)-Ethyl 4-bromobut-2-enoate
Manufacturer: A2B Chem
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CatalogNumber
AB46074
ChemicalName
(E)-Ethyl 4-bromobut-2-enoate
CasNumber
37746-78-4
MolecularFormula
C6H9BrO2
MolecularWeight
193.0385
MdlNumber
MFCD00000247
Smiles
CCOC(=O)/C=C/CBr
Complexity
110
Covalently-bondedUnitCount
1
DefinedBondStereocenterCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
2
RotatableBondCount
4
Xlogp3
1.5
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CatalogNumber: AB46074
ChemicalName: (E)-Ethyl 4-bromobut-2-enoate
CasNumber: 37746-78-4
MolecularFormula: C6H9BrO2
MolecularWeight: 193.0385
MdlNumber: MFCD00000247
Smiles: CCOC(=O)/C=C/CBr
Complexity: 110
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
Xlogp3: 1.5
CatalogNumber:
AB46074
ChemicalName:
(E)-Ethyl 4-bromobut-2-enoate
CasNumber:
37746-78-4
MolecularFormula:
C6H9BrO2
MolecularWeight:
193.0385
MdlNumber:
MFCD00000247
Smiles:
CCOC(=O)/C=C/CBr
Complexity:
110
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
Xlogp3:
1.5
CatalogNumber: AB46075
ChemicalName: Ethyl 4-bromopicolinate
CasNumber: 62150-47-4
MolecularFormula: C8H8BrNO2
MolecularWeight: 230.0586
MdlNumber: MFCD09839150
Smiles: CCOC(=O)c1cc(Br)ccn1
Complexity: 163
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: __
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 2.1
CatalogNumber:
AB46075
ChemicalName:
Ethyl 4-bromopicolinate
CasNumber:
62150-47-4
MolecularFormula:
C8H8BrNO2
MolecularWeight:
230.0586
MdlNumber:
MFCD09839150
Smiles:
CCOC(=O)c1cc(Br)ccn1
Complexity:
163
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
__
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)CC(=O)CCl
Complexity: 133
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 0.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)CC(=O)CCl
Complexity:
133
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
0.9
CatalogNumber: AB46077
ChemicalName: Ethyl 4-fluorobenzoate
CasNumber: 451-46-7
MolecularFormula: C9H9FO2
MolecularWeight: 168.165
MdlNumber: MFCD00000351
Smiles: CCOC(=O)c1ccc(cc1)F
Complexity: 151
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: __
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 2.9
CatalogNumber:
AB46077
ChemicalName:
Ethyl 4-fluorobenzoate
CasNumber:
451-46-7
MolecularFormula:
C9H9FO2
MolecularWeight:
168.165
MdlNumber:
MFCD00000351
Smiles:
CCOC(=O)c1ccc(cc1)F
Complexity:
151
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
__
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
2.9