AB44914
18437-66-6 | tert-Butyl n-(4-chlorophenyl)carbamate
Manufacturer: A2B Chem
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CatalogNumber
AB44914
ChemicalName
tert-Butyl n-(4-chlorophenyl)carbamate
CasNumber
18437-66-6
MolecularFormula
C11H14ClNO2
MolecularWeight
227.6874
MdlNumber
MFCD00816772
Smiles
O=C(Nc1ccc(cc1)Cl)OC(C)(C)C
Complexity
217
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
3.6
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CatalogNumber: AB44914
ChemicalName: tert-Butyl n-(4-chlorophenyl)carbamate
CasNumber: 18437-66-6
MolecularFormula: C11H14ClNO2
MolecularWeight: 227.6874
MdlNumber: MFCD00816772
Smiles: O=C(Nc1ccc(cc1)Cl)OC(C)(C)C
Complexity: 217
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.6
CatalogNumber:
AB44914
ChemicalName:
tert-Butyl n-(4-chlorophenyl)carbamate
CasNumber:
18437-66-6
MolecularFormula:
C11H14ClNO2
MolecularWeight:
227.6874
MdlNumber:
MFCD00816772
Smiles:
O=C(Nc1ccc(cc1)Cl)OC(C)(C)C
Complexity:
217
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCCCCCl
Complexity: 23.5
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCCCCCl
Complexity:
23.5
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.8
CatalogNumber: AB44916
ChemicalName: 4-Chloro-1H-pyrazolo[3,4-d]pyrimidine
CasNumber: 5399-92-8
MolecularFormula: C5H3ClN4
MolecularWeight: 154.5571
MdlNumber: MFCD03030404
Smiles: Clc1ncnc2c1cn[nH]2
Complexity: 131
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 1.1
CatalogNumber:
AB44916
ChemicalName:
4-Chloro-1H-pyrazolo[3,4-d]pyrimidine
CasNumber:
5399-92-8
MolecularFormula:
C5H3ClN4
MolecularWeight:
154.5571
MdlNumber:
MFCD03030404
Smiles:
Clc1ncnc2c1cn[nH]2
Complexity:
131
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
1.1
CatalogNumber: AB44917
ChemicalName: 4-Chloro-2-(trifluoromethyl)benzylamine
CasNumber: 771583-81-4
MolecularFormula: C8H7ClF3N
MolecularWeight: 209.5961
MdlNumber: MFCD06213291
Smiles: NCc1ccc(cc1C(F)(F)F)Cl
Complexity: 171
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.3
CatalogNumber:
AB44917
ChemicalName:
4-Chloro-2-(trifluoromethyl)benzylamine
CasNumber:
771583-81-4
MolecularFormula:
C8H7ClF3N
MolecularWeight:
209.5961
MdlNumber:
MFCD06213291
Smiles:
NCc1ccc(cc1C(F)(F)F)Cl
Complexity:
171
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.3