AB59138
37777-81-4 | (5-Methyl-2-nitrophenyl)acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AB59138
ChemicalName
(5-Methyl-2-nitrophenyl)acetic acid
CasNumber
37777-81-4
MolecularFormula
C9H9NO4
MolecularWeight
195.1721
MdlNumber
MFCD08276003
Smiles
OC(=O)Cc1cc(C)ccc1[N+](=O)[O-]
Complexity
236
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.6
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CatalogNumber: AB59138
ChemicalName: (5-Methyl-2-nitrophenyl)acetic acid
CasNumber: 37777-81-4
MolecularFormula: C9H9NO4
MolecularWeight: 195.1721
MdlNumber: MFCD08276003
Smiles: OC(=O)Cc1cc(C)ccc1[N+](=O)[O-]
Complexity: 236
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.6
CatalogNumber:
AB59138
ChemicalName:
(5-Methyl-2-nitrophenyl)acetic acid
CasNumber:
37777-81-4
MolecularFormula:
C9H9NO4
MolecularWeight:
195.1721
MdlNumber:
MFCD08276003
Smiles:
OC(=O)Cc1cc(C)ccc1[N+](=O)[O-]
Complexity:
236
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1ccc(s1)C1CCCN1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1ccc(s1)C1CCCN1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCCOc1ccc(cn1)[N+](=O)[O-]
Complexity: 170
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCCOc1ccc(cn1)[N+](=O)[O-]
Complexity:
170
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.9
CatalogNumber: AB59141
ChemicalName: 2-(1,3-Oxazol-5-yl)aniline
CasNumber: 774238-36-7
MolecularFormula: C9H8N2O
MolecularWeight: 160.1726
MdlNumber: MFCD07772822
Smiles: Nc1ccccc1c1cnco1
Complexity: 152
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.3
CatalogNumber:
AB59141
ChemicalName:
2-(1,3-Oxazol-5-yl)aniline
CasNumber:
774238-36-7
MolecularFormula:
C9H8N2O
MolecularWeight:
160.1726
MdlNumber:
MFCD07772822
Smiles:
Nc1ccccc1c1cnco1
Complexity:
152
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.3