AI53158
58804-17-4 | Methyl 4-[(dimethylamino)sulfonyl]benzoate
Manufacturer: A2B Chem
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CatalogNumber
AI53158
ChemicalName
Methyl 4-[(dimethylamino)sulfonyl]benzoate
CasNumber
58804-17-4
MolecularFormula
C10H13NO4S
MolecularWeight
243.2795
MdlNumber
MFCD01113321
Smiles
COC(=O)c1ccc(cc1)S(=O)(=O)N(C)C
Complexity
336
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
RotatableBondCount
4
Xlogp3
1.2
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CatalogNumber: AI53158
ChemicalName: Methyl 4-[(dimethylamino)sulfonyl]benzoate
CasNumber: 58804-17-4
MolecularFormula: C10H13NO4S
MolecularWeight: 243.2795
MdlNumber: MFCD01113321
Smiles: COC(=O)c1ccc(cc1)S(=O)(=O)N(C)C
Complexity: 336
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
RotatableBondCount: 4
Xlogp3: 1.2
CatalogNumber:
AI53158
ChemicalName:
Methyl 4-[(dimethylamino)sulfonyl]benzoate
CasNumber:
58804-17-4
MolecularFormula:
C10H13NO4S
MolecularWeight:
243.2795
MdlNumber:
MFCD01113321
Smiles:
COC(=O)c1ccc(cc1)S(=O)(=O)N(C)C
Complexity:
336
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
RotatableBondCount:
4
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C(=Cc1ccccc1C(F)(F)F)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C(=Cc1ccccc1C(F)(F)F)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI53160
ChemicalName: 4-(Dimethylamino)phenol hydrochloride
CasNumber: 5882-48-4
MolecularFormula: C8H12ClNO
MolecularWeight: 173.64
MdlNumber: MFCD01707511
Smiles: CN(c1ccc(cc1)O)C.Cl
Complexity: 95.4
Covalently-bondedUnitCount: 2
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AI53160
ChemicalName:
4-(Dimethylamino)phenol hydrochloride
CasNumber:
5882-48-4
MolecularFormula:
C8H12ClNO
MolecularWeight:
173.64
MdlNumber:
MFCD01707511
Smiles:
CN(c1ccc(cc1)O)C.Cl
Complexity:
95.4
Covalently-bondedUnitCount:
2
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)Cc1ccc(cc1)NS(=O)(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)Cc1ccc(cc1)NS(=O)(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__