AI39105
173411-50-2 | tert-Butyl n-[2-(1,3-dithian-2-yl)-2-oxoethyl]carbamate
Manufacturer: A2B Chem
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CatalogNumber
AI39105
ChemicalName
tert-Butyl n-[2-(1,3-dithian-2-yl)-2-oxoethyl]carbamate
CasNumber
173411-50-2
MolecularFormula
C11H19NO3S2
MolecularWeight
277.4035
MdlNumber
MFCD24473439
Smiles
O=C(C1SCCCS1)CNC(=O)OC(C)(C)C
Complexity
283
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
2.3
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CatalogNumber: AI39105
ChemicalName: tert-Butyl n-[2-(1,3-dithian-2-yl)-2-oxoethyl]carbamate
CasNumber: 173411-50-2
MolecularFormula: C11H19NO3S2
MolecularWeight: 277.4035
MdlNumber: MFCD24473439
Smiles: O=C(C1SCCCS1)CNC(=O)OC(C)(C)C
Complexity: 283
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 2.3
CatalogNumber:
AI39105
ChemicalName:
tert-Butyl n-[2-(1,3-dithian-2-yl)-2-oxoethyl]carbamate
CasNumber:
173411-50-2
MolecularFormula:
C11H19NO3S2
MolecularWeight:
277.4035
MdlNumber:
MFCD24473439
Smiles:
O=C(C1SCCCS1)CNC(=O)OC(C)(C)C
Complexity:
283
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
2.3
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Smiles: CC(COc1ccc(cc1)Cl)C
Complexity: __
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Smiles:
CC(COc1ccc(cc1)Cl)C
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Smiles: Oc1ccc(c(c1O)O)Br
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Oc1ccc(c(c1O)O)Br
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RotatableBondCount:
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Smiles: C=CCC(c1ccc(c(c1)Cl)Cl)C(=O)OC
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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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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MdlNumber:
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Smiles:
C=CCC(c1ccc(c(c1)Cl)Cl)C(=O)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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