AE46286
117324-16-0 | Methyl 2-amino-5-(thiocyanato)benzoate
Manufacturer: A2B Chem
The price for this product is unavailable. Please request a quote
CatalogNumber
AE46286
ChemicalName
Methyl 2-amino-5-(thiocyanato)benzoate
CasNumber
117324-16-0
MolecularFormula
C9H8N2O2S
MolecularWeight
208.237
MdlNumber
MFCD03176138
Smiles
N#CSc1ccc(c(c1)C(=O)OC)N
Complexity
261
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
3.2
Related Products
Compare Similar Items
Show Difference
CatalogNumber: AE46286
ChemicalName: Methyl 2-amino-5-(thiocyanato)benzoate
CasNumber: 117324-16-0
MolecularFormula: C9H8N2O2S
MolecularWeight: 208.237
MdlNumber: MFCD03176138
Smiles: N#CSc1ccc(c(c1)C(=O)OC)N
Complexity: 261
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.2
CatalogNumber:
AE46286
ChemicalName:
Methyl 2-amino-5-(thiocyanato)benzoate
CasNumber:
117324-16-0
MolecularFormula:
C9H8N2O2S
MolecularWeight:
208.237
MdlNumber:
MFCD03176138
Smiles:
N#CSc1ccc(c(c1)C(=O)OC)N
Complexity:
261
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)Nc1cccc2c1sc(n2)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)Nc1cccc2c1sc(n2)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1ccc2c(c1)nc(s2)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1ccc2c(c1)nc(s2)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CO[C@@H]1[C@@H](O)C(O[C@H]2C(O[C@@H]([C@H]3[C@@H]2O[C@@H](O3)c2ccccc2)C)Oc2cccc3c2c2oc(=O)c4c5c2c(c3O)c(=O)oc5ccc4C)O[C@@H]([C@@H]1O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CO[C@@H]1[C@@H](O)C(O[C@H]2C(O[C@@H]([C@H]3[C@@H]2O[C@@H](O3)c2ccccc2)C)Oc2cccc3c2c2oc(=O)c4c5c2c(c3O)c(=O)oc5ccc4C)O[C@@H]([C@@H]1O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__