AA71631
14438-32-5 | 2-Amino-3,5-dimethylbenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA71631
ChemicalName
2-Amino-3,5-dimethylbenzoic acid
CasNumber
14438-32-5
MolecularFormula
C9H11NO2
MolecularWeight
165.1891
MdlNumber
MFCD00017099
Smiles
Cc1cc(C)c(c(c1)C(=O)O)N
NscNumber
90444
Complexity
181
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
2
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CatalogNumber: AA71631
ChemicalName: 2-Amino-3,5-dimethylbenzoic acid
CasNumber: 14438-32-5
MolecularFormula: C9H11NO2
MolecularWeight: 165.1891
MdlNumber: MFCD00017099
Smiles: Cc1cc(C)c(c(c1)C(=O)O)N
NscNumber: 90444
Complexity: 181
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AA71631
ChemicalName:
2-Amino-3,5-dimethylbenzoic acid
CasNumber:
14438-32-5
MolecularFormula:
C9H11NO2
MolecularWeight:
165.1891
MdlNumber:
MFCD00017099
Smiles:
Cc1cc(C)c(c(c1)C(=O)O)N
NscNumber:
90444
Complexity:
181
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC[C@H](CBr)O
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC[C@H](CBr)O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)C(Cc1ccc(cc1)Cl)Cl
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)C(Cc1ccc(cc1)Cl)Cl
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA71635
ChemicalName: Methyl tosylcarbamate
CasNumber: 14437-03-7
MolecularFormula: C9H11NO4S
MolecularWeight: 229.2529
MdlNumber: MFCD00453717
Smiles: COC(=O)NS(=O)(=O)c1ccc(cc1)C
NscNumber: __
Complexity: 312
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.8
CatalogNumber:
AA71635
ChemicalName:
Methyl tosylcarbamate
CasNumber:
14437-03-7
MolecularFormula:
C9H11NO4S
MolecularWeight:
229.2529
MdlNumber:
MFCD00453717
Smiles:
COC(=O)NS(=O)(=O)c1ccc(cc1)C
NscNumber:
__
Complexity:
312
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.8