AC82396
67929-86-6 | 5-Methoxy-1H-indole-2-carboxylic acid methyl ester
Manufacturer: A2B Chem
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CatalogNumber
AC82396
ChemicalName
5-Methoxy-1H-indole-2-carboxylic acid methyl ester
CasNumber
67929-86-6
MolecularFormula
C11H11NO3
MolecularWeight
205.2099
MdlNumber
MFCD01074509
Smiles
COc1ccc2c(c1)cc([nH]2)C(=O)OC
Complexity
244
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.4
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CatalogNumber: AC82396
ChemicalName: 5-Methoxy-1H-indole-2-carboxylic acid methyl ester
CasNumber: 67929-86-6
MolecularFormula: C11H11NO3
MolecularWeight: 205.2099
MdlNumber: MFCD01074509
Smiles: COc1ccc2c(c1)cc([nH]2)C(=O)OC
Complexity: 244
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.4
CatalogNumber:
AC82396
ChemicalName:
5-Methoxy-1H-indole-2-carboxylic acid methyl ester
CasNumber:
67929-86-6
MolecularFormula:
C11H11NO3
MolecularWeight:
205.2099
MdlNumber:
MFCD01074509
Smiles:
COc1ccc2c(c1)cc([nH]2)C(=O)OC
Complexity:
244
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.4
CatalogNumber: AC82397
ChemicalName: 6-Bromo-3-methyl-2,3-dihydro-1,3-benzoxazol-2-one
CasNumber: 67927-44-0
MolecularFormula: C8H6BrNO2
MolecularWeight: 228.0427
MdlNumber: MFCD00694789
Smiles: Brc1ccc2c(c1)oc(=O)n2C
Complexity: 209
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2
CatalogNumber:
AC82397
ChemicalName:
6-Bromo-3-methyl-2,3-dihydro-1,3-benzoxazol-2-one
CasNumber:
67927-44-0
MolecularFormula:
C8H6BrNO2
MolecularWeight:
228.0427
MdlNumber:
MFCD00694789
Smiles:
Brc1ccc2c(c1)oc(=O)n2C
Complexity:
209
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)O.NCCNCCNCCNCCNCCN
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)O.NCCNCCNCCNCCNCCN
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC1=NCC(S1)CO
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC1=NCC(S1)CO
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__