AB03368
201940-08-1 | tert-Butyl 5-bromoisoindoline-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB03368
ChemicalName
tert-Butyl 5-bromoisoindoline-2-carboxylate
CasNumber
201940-08-1
MolecularFormula
C13H16BrNO2
MolecularWeight
298.1756
MdlNumber
MFCD09953049
Smiles
Brc1ccc2c(c1)CN(C2)C(=O)OC(C)(C)C
Complexity
300
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
2.9
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CatalogNumber: AB03368
ChemicalName: tert-Butyl 5-bromoisoindoline-2-carboxylate
CasNumber: 201940-08-1
MolecularFormula: C13H16BrNO2
MolecularWeight: 298.1756
MdlNumber: MFCD09953049
Smiles: Brc1ccc2c(c1)CN(C2)C(=O)OC(C)(C)C
Complexity: 300
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 2.9
CatalogNumber:
AB03368
ChemicalName:
tert-Butyl 5-bromoisoindoline-2-carboxylate
CasNumber:
201940-08-1
MolecularFormula:
C13H16BrNO2
MolecularWeight:
298.1756
MdlNumber:
MFCD09953049
Smiles:
Brc1ccc2c(c1)CN(C2)C(=O)OC(C)(C)C
Complexity:
300
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
2.9
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Smiles: N(Cc1ncc[nH]1)Cc1ncc[nH]1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
N(Cc1ncc[nH]1)Cc1ncc[nH]1
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
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Smiles: Clc1ccc(cn1)C(=N)N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
Clc1ccc(cn1)C(=N)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1ccc(cn1)C(=N)N.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1ccc(cn1)C(=N)N.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__