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AA37271

126535-26-0 | Methyl 2-(chlorosulfonyl)-3-methylbenzoate

Manufacturer: A2B Chem

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CatalogNumber

AA37271

ChemicalName

Methyl 2-(chlorosulfonyl)-3-methylbenzoate

CasNumber

126535-26-0

MolecularFormula

C9H9ClO4S

MolecularWeight

248.6834

MdlNumber

MFCD09030584

Smiles

COC(=O)c1cccc(c1S(=O)(=O)Cl)C

Complexity

333

Covalently-bondedUnitCount

1

HeavyAtomCount

15

HydrogenBondAcceptorCount

4

RotatableBondCount

3

Xlogp3

2.2

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Img

A2B Chem

AA37271

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CatalogNumber:
AA37271
ChemicalName:
Methyl 2-(chlorosulfonyl)-3-methylbenzoate
CasNumber:
126535-26-0
MolecularFormula:
C9H9ClO4S
MolecularWeight:
248.6834
MdlNumber:
MFCD09030584
Smiles:
COC(=O)c1cccc(c1S(=O)(=O)Cl)C
Complexity:
333
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
2.2

Img

A2B Chem

AA37272

--

CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cccc(c1S(=O)(=O)NC(=O)Nc1nc(OCC(F)(F)F)nc(n1)N(C)C)C
Complexity:
793
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3.1

Img

A2B Chem

AA37273

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CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NN=Cc1cccc(c1)C=NNC(=N)NN=Cc1cccc(c1)C=NN.Cl.Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__

Img

A2B Chem

AA37274

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CatalogNumber:
AA37274
ChemicalName:
3-Formylbenzamide
CasNumber:
126534-87-0
MolecularFormula:
C8H7NO2
MolecularWeight:
149.1467
MdlNumber:
MFCD09758970
Smiles:
O=Cc1cccc(c1)C(=O)N
Complexity:
168
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
0.4