AA38308
129822-39-5 | tert-Butyl N-(3-chloro-2-methylphenyl)carbamate
Manufacturer: A2B Chem
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CatalogNumber
AA38308
ChemicalName
tert-Butyl N-(3-chloro-2-methylphenyl)carbamate
CasNumber
129822-39-5
MolecularFormula
C12H16ClNO2
MolecularWeight
241.7139
MdlNumber
MFCD07127715
Smiles
O=C(Nc1cccc(c1C)Cl)OC(C)(C)C
Complexity
250
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
3.2
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CatalogNumber: AA38308
ChemicalName: tert-Butyl N-(3-chloro-2-methylphenyl)carbamate
CasNumber: 129822-39-5
MolecularFormula: C12H16ClNO2
MolecularWeight: 241.7139
MdlNumber: MFCD07127715
Smiles: O=C(Nc1cccc(c1C)Cl)OC(C)(C)C
Complexity: 250
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.2
CatalogNumber:
AA38308
ChemicalName:
tert-Butyl N-(3-chloro-2-methylphenyl)carbamate
CasNumber:
129822-39-5
MolecularFormula:
C12H16ClNO2
MolecularWeight:
241.7139
MdlNumber:
MFCD07127715
Smiles:
O=C(Nc1cccc(c1C)Cl)OC(C)(C)C
Complexity:
250
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.2
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Smiles: O=C(Nc1cccc(c1C)F)OC(C)(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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Smiles:
O=C(Nc1cccc(c1C)F)OC(C)(C)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: Nc1ccc2c(c1)[nH]c1c(c2=S)cccc1
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Smiles:
Nc1ccc2c(c1)[nH]c1c(c2=S)cccc1
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HeavyAtomCount:
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Smiles: O=C(Oc1c(F)c(F)c(c(c1F)F)F)CSC(=O)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(Oc1c(F)c(F)c(c(c1F)F)F)CSC(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__