AA83278
16136-58-6 | 1-Methylindole-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA83278
ChemicalName
1-Methylindole-2-carboxylic acid
CasNumber
16136-58-6
MolecularFormula
C10H9NO2
MolecularWeight
175.184
MdlNumber
MFCD00005801
Smiles
OC(=O)c1cc2c(n1C)cccc2
NscNumber
68357
Complexity
217
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2
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CatalogNumber: AA83278
ChemicalName: 1-Methylindole-2-carboxylic acid
CasNumber: 16136-58-6
MolecularFormula: C10H9NO2
MolecularWeight: 175.184
MdlNumber: MFCD00005801
Smiles: OC(=O)c1cc2c(n1C)cccc2
NscNumber: 68357
Complexity: 217
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AA83278
ChemicalName:
1-Methylindole-2-carboxylic acid
CasNumber:
16136-58-6
MolecularFormula:
C10H9NO2
MolecularWeight:
175.184
MdlNumber:
MFCD00005801
Smiles:
OC(=O)c1cc2c(n1C)cccc2
NscNumber:
68357
Complexity:
217
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2
CatalogNumber: AA83279
ChemicalName: 4-Cyanoindole
CasNumber: 16136-52-0
MolecularFormula: C9H6N2
MolecularWeight: 142.15734
MdlNumber: MFCD00152045
Smiles: N#Cc1cccc2c1cc[nH]2
NscNumber: __
Complexity: 191
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 2.5
CatalogNumber:
AA83279
ChemicalName:
4-Cyanoindole
CasNumber:
16136-52-0
MolecularFormula:
C9H6N2
MolecularWeight:
142.15734
MdlNumber:
MFCD00152045
Smiles:
N#Cc1cccc2c1cc[nH]2
NscNumber:
__
Complexity:
191
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1nc(=O)c2n([nH]1)ccc2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1nc(=O)c2n([nH]1)ccc2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClC(=O)c1ccc2c(c1)cc[nH]2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClC(=O)c1ccc2c(c1)cc[nH]2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__