AB48158
84540-59-0 | 4-(Chloromethyl)-1-methyl-2-nitrobenzene
Manufacturer: A2B Chem
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CatalogNumber
AB48158
ChemicalName
4-(Chloromethyl)-1-methyl-2-nitrobenzene
CasNumber
84540-59-0
MolecularFormula
C8H8ClNO2
MolecularWeight
185.6076
MdlNumber
MFCD00044646
Smiles
ClCc1ccc(c(c1)[N+](=O)[O-])C
Complexity
169
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
2.5
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CatalogNumber: AB48158
ChemicalName: 4-(Chloromethyl)-1-methyl-2-nitrobenzene
CasNumber: 84540-59-0
MolecularFormula: C8H8ClNO2
MolecularWeight: 185.6076
MdlNumber: MFCD00044646
Smiles: ClCc1ccc(c(c1)[N+](=O)[O-])C
Complexity: 169
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 2.5
CatalogNumber:
AB48158
ChemicalName:
4-(Chloromethyl)-1-methyl-2-nitrobenzene
CasNumber:
84540-59-0
MolecularFormula:
C8H8ClNO2
MolecularWeight:
185.6076
MdlNumber:
MFCD00044646
Smiles:
ClCc1ccc(c(c1)[N+](=O)[O-])C
Complexity:
169
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)NCC(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)NCC(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB48160
ChemicalName: 3,6-Dimethyl-2-pyridinamine
CasNumber: 823-61-0
MolecularFormula: C7H10N2
MolecularWeight: 122.1677
MdlNumber: MFCD06637718
Smiles: Cc1ccc(c(n1)N)C
Complexity: 92.9
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
RotatableBondCount: __
Xlogp3: 1.3
CatalogNumber:
AB48160
ChemicalName:
3,6-Dimethyl-2-pyridinamine
CasNumber:
823-61-0
MolecularFormula:
C7H10N2
MolecularWeight:
122.1677
MdlNumber:
MFCD06637718
Smiles:
Cc1ccc(c(n1)N)C
Complexity:
92.9
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
RotatableBondCount:
__
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC[C@H]([C@H]([C@H](Cn1c2cc(C)c(cc2nc2c1nc(=O)[nH]c2=O)C)O)O)O
Complexity: 680
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: -1.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC[C@H]([C@H]([C@H](Cn1c2cc(C)c(cc2nc2c1nc(=O)[nH]c2=O)C)O)O)O
Complexity:
680
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
-1.5