AB51155
38446-95-6 | tert-Butyl 4-oxocyclohexanecarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB51155
ChemicalName
tert-Butyl 4-oxocyclohexanecarboxylate
CasNumber
38446-95-6
MolecularFormula
C11H18O3
MolecularWeight
198.2588
MdlNumber
MFCD08061192
Smiles
O=C(C1CCC(=O)CC1)OC(C)(C)C
Complexity
227
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
1.2
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CatalogNumber: AB51155
ChemicalName: tert-Butyl 4-oxocyclohexanecarboxylate
CasNumber: 38446-95-6
MolecularFormula: C11H18O3
MolecularWeight: 198.2588
MdlNumber: MFCD08061192
Smiles: O=C(C1CCC(=O)CC1)OC(C)(C)C
Complexity: 227
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 1.2
CatalogNumber:
AB51155
ChemicalName:
tert-Butyl 4-oxocyclohexanecarboxylate
CasNumber:
38446-95-6
MolecularFormula:
C11H18O3
MolecularWeight:
198.2588
MdlNumber:
MFCD08061192
Smiles:
O=C(C1CCC(=O)CC1)OC(C)(C)C
Complexity:
227
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C=Cc1cccc(c1)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C=Cc1cccc(c1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB51159
ChemicalName: 5-Isopropyl-1h-indole-2-carboxylic acid
CasNumber: 383132-39-6
MolecularFormula: C12H13NO2
MolecularWeight: 203.2371
MdlNumber: MFCD02664438
Smiles: CC(c1ccc2c(c1)cc([nH]2)C(=O)O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AB51159
ChemicalName:
5-Isopropyl-1h-indole-2-carboxylic acid
CasNumber:
383132-39-6
MolecularFormula:
C12H13NO2
MolecularWeight:
203.2371
MdlNumber:
MFCD02664438
Smiles:
CC(c1ccc2c(c1)cc([nH]2)C(=O)O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__