AA64936
1467-70-5 | 2-(Furan-2-yl)-2-oxoacetic acid
Manufacturer: A2B Chem
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CatalogNumber
AA64936
ChemicalName
2-(Furan-2-yl)-2-oxoacetic acid
CasNumber
1467-70-5
MolecularFormula
C6H4O4
MolecularWeight
140.0936
MdlNumber
MFCD00042671
Smiles
OC(=O)C(=O)c1ccco1
NscNumber
59069
Complexity
163
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
0.3
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CatalogNumber: AA64936
ChemicalName: 2-(Furan-2-yl)-2-oxoacetic acid
CasNumber: 1467-70-5
MolecularFormula: C6H4O4
MolecularWeight: 140.0936
MdlNumber: MFCD00042671
Smiles: OC(=O)C(=O)c1ccco1
NscNumber: 59069
Complexity: 163
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.3
CatalogNumber:
AA64936
ChemicalName:
2-(Furan-2-yl)-2-oxoacetic acid
CasNumber:
1467-70-5
MolecularFormula:
C6H4O4
MolecularWeight:
140.0936
MdlNumber:
MFCD00042671
Smiles:
OC(=O)C(=O)c1ccco1
NscNumber:
59069
Complexity:
163
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(CC(=O)c1ccccc1)CC(=O)c1ccccc1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(CC(=O)c1ccccc1)CC(=O)c1ccccc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1ccc(c(c1C)C)N
NscNumber: __
Complexity: 111
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1ccc(c(c1C)C)N
NscNumber:
__
Complexity:
111
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.3
CatalogNumber: AA64946
ChemicalName: Boc-d-4-cyanophenylalanine
CasNumber: 146727-62-0
MolecularFormula: C15H18N2O4
MolecularWeight: 290.3144
MdlNumber: MFCD00672527
Smiles: N#Cc1ccc(cc1)C[C@H](C(=O)O)NC(=O)OC(C)(C)C
NscNumber: __
Complexity: 425
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 6
Xlogp3: 1.5
CatalogNumber:
AA64946
ChemicalName:
Boc-d-4-cyanophenylalanine
CasNumber:
146727-62-0
MolecularFormula:
C15H18N2O4
MolecularWeight:
290.3144
MdlNumber:
MFCD00672527
Smiles:
N#Cc1ccc(cc1)C[C@H](C(=O)O)NC(=O)OC(C)(C)C
NscNumber:
__
Complexity:
425
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
6
Xlogp3:
1.5