AB08464
198995-91-4 | Benzyl 3-oxocyclobutanecarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB08464
ChemicalName
Benzyl 3-oxocyclobutanecarboxylate
CasNumber
198995-91-4
MolecularFormula
C12H12O3
MolecularWeight
204.2219
MdlNumber
MFCD11848894
Smiles
O=C(C1CC(=O)C1)OCc1ccccc1
Complexity
246
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
RotatableBondCount
4
Xlogp3
1
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CatalogNumber: AB08464
ChemicalName: Benzyl 3-oxocyclobutanecarboxylate
CasNumber: 198995-91-4
MolecularFormula: C12H12O3
MolecularWeight: 204.2219
MdlNumber: MFCD11848894
Smiles: O=C(C1CC(=O)C1)OCc1ccccc1
Complexity: 246
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 1
CatalogNumber:
AB08464
ChemicalName:
Benzyl 3-oxocyclobutanecarboxylate
CasNumber:
198995-91-4
MolecularFormula:
C12H12O3
MolecularWeight:
204.2219
MdlNumber:
MFCD11848894
Smiles:
O=C(C1CC(=O)C1)OCc1ccccc1
Complexity:
246
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N)Cc1c[nH]c2c1cccc2)CC(C)C)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
NCCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N)Cc1c[nH]c2c1cccc2)CC(C)C)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB08466
ChemicalName: Methyl 2-hydroxybiphenyl-4-carboxylate
CasNumber: 198994-00-2
MolecularFormula: C14H12O3
MolecularWeight: 228.2433
MdlNumber: MFCD27987242
Smiles: COC(=O)c1ccc(c(c1)O)c1ccccc1
Complexity: 258
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 3
CatalogNumber:
AB08466
ChemicalName:
Methyl 2-hydroxybiphenyl-4-carboxylate
CasNumber:
198994-00-2
MolecularFormula:
C14H12O3
MolecularWeight:
228.2433
MdlNumber:
MFCD27987242
Smiles:
COC(=O)c1ccc(c(c1)O)c1ccccc1
Complexity:
258
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)[C@@H]1CNCCN1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)[C@@H]1CNCCN1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__