AB28715
260412-75-7 | t-Butyl 1,3-dihydroisoindole-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB28715
ChemicalName
t-Butyl 1,3-dihydroisoindole-2-carboxylate
CasNumber
260412-75-7
MolecularFormula
C13H17NO2
MolecularWeight
219.2796
MdlNumber
MFCD21106377
Smiles
O=C(N1Cc2c(C1)cccc2)OC(C)(C)C
Complexity
256
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
2.2
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CatalogNumber: AB28715
ChemicalName: t-Butyl 1,3-dihydroisoindole-2-carboxylate
CasNumber: 260412-75-7
MolecularFormula: C13H17NO2
MolecularWeight: 219.2796
MdlNumber: MFCD21106377
Smiles: O=C(N1Cc2c(C1)cccc2)OC(C)(C)C
Complexity: 256
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 2.2
CatalogNumber:
AB28715
ChemicalName:
t-Butyl 1,3-dihydroisoindole-2-carboxylate
CasNumber:
260412-75-7
MolecularFormula:
C13H17NO2
MolecularWeight:
219.2796
MdlNumber:
MFCD21106377
Smiles:
O=C(N1Cc2c(C1)cccc2)OC(C)(C)C
Complexity:
256
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
2.2
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MolecularFormula: __
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Smiles: CCNc1cc(C)ccc1F
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
CCNc1cc(C)ccc1F
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: F[P-](F)(F)(F)(F)F.[Ag+]
Complexity: 62.7
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HydrogenBondAcceptorCount: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
F[P-](F)(F)(F)(F)F.[Ag+]
Complexity:
62.7
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: OC(=O)[C@H](Cc1cc(I)c(c(c1)I)Oc1cc(I)c(c(c1)I)O)NC(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
OC(=O)[C@H](Cc1cc(I)c(c(c1)I)Oc1cc(I)c(c(c1)I)O)NC(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__