AB44257
847416-99-3 | tert-Butyl 3-oxocyclopentylcarbamate
Manufacturer: A2B Chem
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CatalogNumber
AB44257
ChemicalName
tert-Butyl 3-oxocyclopentylcarbamate
CasNumber
847416-99-3
MolecularFormula
C10H17NO3
MolecularWeight
199.2469
MdlNumber
MFCD09751875
Smiles
O=C1CCC(C1)NC(=O)OC(C)(C)C
Complexity
242
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
0.8
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CatalogNumber: AB44257
ChemicalName: tert-Butyl 3-oxocyclopentylcarbamate
CasNumber: 847416-99-3
MolecularFormula: C10H17NO3
MolecularWeight: 199.2469
MdlNumber: MFCD09751875
Smiles: O=C1CCC(C1)NC(=O)OC(C)(C)C
Complexity: 242
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.8
CatalogNumber:
AB44257
ChemicalName:
tert-Butyl 3-oxocyclopentylcarbamate
CasNumber:
847416-99-3
MolecularFormula:
C10H17NO3
MolecularWeight:
199.2469
MdlNumber:
MFCD09751875
Smiles:
O=C1CCC(C1)NC(=O)OC(C)(C)C
Complexity:
242
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(OC(C)(C)C)NCC1CNC1
Complexity: 183
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 0.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(OC(C)(C)C)NCC1CNC1
Complexity:
183
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
0.5
CatalogNumber: AB44259
ChemicalName: 3-(Bromomethyl)pyridine hydrobromide
CasNumber: 4916-55-6
MolecularFormula: C6H7Br2N
MolecularWeight: 252.93447999999995
MdlNumber: MFCD01321314
Smiles: BrCc1cccnc1.Br
Complexity: 65.5
Covalently-bondedUnitCount: 2
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 1
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
AB44259
ChemicalName:
3-(Bromomethyl)pyridine hydrobromide
CasNumber:
4916-55-6
MolecularFormula:
C6H7Br2N
MolecularWeight:
252.93447999999995
MdlNumber:
MFCD01321314
Smiles:
BrCc1cccnc1.Br
Complexity:
65.5
Covalently-bondedUnitCount:
2
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB44260
ChemicalName: 3-(Chloromethyl)-4-methyl-1,2,5-oxadiazole
CasNumber: 62642-47-1
MolecularFormula: C4H5ClN2O
MolecularWeight: 132.5483
MdlNumber: MFCD01875219
Smiles: Cc1nonc1CCl
Complexity: 80.4
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 1
UndefinedAtomStereocenterCount: __
Xlogp3: 0.6
CatalogNumber:
AB44260
ChemicalName:
3-(Chloromethyl)-4-methyl-1,2,5-oxadiazole
CasNumber:
62642-47-1
MolecularFormula:
C4H5ClN2O
MolecularWeight:
132.5483
MdlNumber:
MFCD01875219
Smiles:
Cc1nonc1CCl
Complexity:
80.4
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
__
Xlogp3:
0.6