AI49654
393078-37-0 | (2,3-Dichloro-6-nitrophenyl)methanol
Manufacturer: A2B Chem
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CatalogNumber
AI49654
ChemicalName
(2,3-Dichloro-6-nitrophenyl)methanol
CasNumber
393078-37-0
MolecularFormula
C7H5Cl2NO3
MolecularWeight
222.0255
MdlNumber
MFCD11111011
Smiles
OCc1c(ccc(c1Cl)Cl)[N+](=O)[O-]
Complexity
197
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AI49654
ChemicalName: (2,3-Dichloro-6-nitrophenyl)methanol
CasNumber: 393078-37-0
MolecularFormula: C7H5Cl2NO3
MolecularWeight: 222.0255
MdlNumber: MFCD11111011
Smiles: OCc1c(ccc(c1Cl)Cl)[N+](=O)[O-]
Complexity: 197
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AI49654
ChemicalName:
(2,3-Dichloro-6-nitrophenyl)methanol
CasNumber:
393078-37-0
MolecularFormula:
C7H5Cl2NO3
MolecularWeight:
222.0255
MdlNumber:
MFCD11111011
Smiles:
OCc1c(ccc(c1Cl)Cl)[N+](=O)[O-]
Complexity:
197
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@@H](Cc1ncn(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)OC(C)(C)C
Complexity: 703
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 5.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@@H](Cc1ncn(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)OC(C)(C)C
Complexity:
703
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
5.4
CatalogNumber: AI49656
ChemicalName: 1-N-(tert-Butoxycarbonyl)-2-ethyl-piperazine
CasNumber: 393781-71-0
MolecularFormula: C11H22N2O2
MolecularWeight: 214.3046
MdlNumber: MFCD03265490
Smiles: CCC1CNCCN1C(=O)OC(C)(C)C
Complexity: 223
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.4
CatalogNumber:
AI49656
ChemicalName:
1-N-(tert-Butoxycarbonyl)-2-ethyl-piperazine
CasNumber:
393781-71-0
MolecularFormula:
C11H22N2O2
MolecularWeight:
214.3046
MdlNumber:
MFCD03265490
Smiles:
CCC1CNCCN1C(=O)OC(C)(C)C
Complexity:
223
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)c1ccc(cc1)NS(=O)(=O)c1ccc(cc1)C(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)c1ccc(cc1)NS(=O)(=O)c1ccc(cc1)C(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__