AA67834
1414959-14-0 | tert-Butyl (4-(2-chloroacetyl)phenyl)carbamate
Manufacturer: A2B Chem
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CatalogNumber
AA67834
ChemicalName
tert-Butyl (4-(2-chloroacetyl)phenyl)carbamate
CasNumber
1414959-14-0
MolecularFormula
C13H16ClNO3
MolecularWeight
269.724
MdlNumber
MFCD22689191
Smiles
ClCC(=O)c1ccc(cc1)NC(=O)OC(C)(C)C
Complexity
304
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
2.8
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CatalogNumber: AA67834
ChemicalName: tert-Butyl (4-(2-chloroacetyl)phenyl)carbamate
CasNumber: 1414959-14-0
MolecularFormula: C13H16ClNO3
MolecularWeight: 269.724
MdlNumber: MFCD22689191
Smiles: ClCC(=O)c1ccc(cc1)NC(=O)OC(C)(C)C
Complexity: 304
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 2.8
CatalogNumber:
AA67834
ChemicalName:
tert-Butyl (4-(2-chloroacetyl)phenyl)carbamate
CasNumber:
1414959-14-0
MolecularFormula:
C13H16ClNO3
MolecularWeight:
269.724
MdlNumber:
MFCD22689191
Smiles:
ClCC(=O)c1ccc(cc1)NC(=O)OC(C)(C)C
Complexity:
304
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
2.8
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Smiles: O=C1OCC(N1C1CCNCC1)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
O=C1OCC(N1C1CCNCC1)c1ccccc1
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: COC(=O)c1cccc2c1ccc(n2)N
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Smiles:
COC(=O)c1cccc2c1ccc(n2)N
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: O=C1C=C[C@H](N1)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1C=C[C@H](N1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__