AB59100
54941-44-5 | 4-Methyl-3-nitrophenylacetic acid
Manufacturer: A2B Chem
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CatalogNumber
AB59100
ChemicalName
4-Methyl-3-nitrophenylacetic acid
CasNumber
54941-44-5
MolecularFormula
C9H9NO4
MolecularWeight
195.17206000000002
MdlNumber
MFCD09832994
Smiles
OC(=O)Cc1ccc(c(c1)[N+](=O)[O-])C
Complexity
236
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.6
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CatalogNumber: AB59100
ChemicalName: 4-Methyl-3-nitrophenylacetic acid
CasNumber: 54941-44-5
MolecularFormula: C9H9NO4
MolecularWeight: 195.17206000000002
MdlNumber: MFCD09832994
Smiles: OC(=O)Cc1ccc(c(c1)[N+](=O)[O-])C
Complexity: 236
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.6
CatalogNumber:
AB59100
ChemicalName:
4-Methyl-3-nitrophenylacetic acid
CasNumber:
54941-44-5
MolecularFormula:
C9H9NO4
MolecularWeight:
195.17206000000002
MdlNumber:
MFCD09832994
Smiles:
OC(=O)Cc1ccc(c(c1)[N+](=O)[O-])C
Complexity:
236
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1ncsc1CC(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1ncsc1CC(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB59102
ChemicalName: 2-(4-Methylcyclohexylidene)acetic acid
CasNumber: 77842-31-0
MolecularFormula: C9H14O2
MolecularWeight: 154.2063
MdlNumber: MFCD00029539
Smiles: CC1CC/C(=C/C(=O)O)/CC1
Complexity: 172
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AB59102
ChemicalName:
2-(4-Methylcyclohexylidene)acetic acid
CasNumber:
77842-31-0
MolecularFormula:
C9H14O2
MolecularWeight:
154.2063
MdlNumber:
MFCD00029539
Smiles:
CC1CC/C(=C/C(=O)O)/CC1
Complexity:
172
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Cc1ccccc1Oc1ccc(cc1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1ccccc1Oc1ccc(cc1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__