AI49320
380448-07-7 | 5-Chloro-3-formyl-1h-indole-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AI49320
ChemicalName
5-Chloro-3-formyl-1h-indole-2-carboxylic acid
CasNumber
380448-07-7
MolecularFormula
C10H6ClNO3
MolecularWeight
223.6125
MdlNumber
MFCD04966951
Smiles
O=Cc1c([nH]c2c1cc(Cl)cc2)C(=O)O
Complexity
284
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
2
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CatalogNumber: AI49320
ChemicalName: 5-Chloro-3-formyl-1h-indole-2-carboxylic acid
CasNumber: 380448-07-7
MolecularFormula: C10H6ClNO3
MolecularWeight: 223.6125
MdlNumber: MFCD04966951
Smiles: O=Cc1c([nH]c2c1cc(Cl)cc2)C(=O)O
Complexity: 284
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 2
CatalogNumber:
AI49320
ChemicalName:
5-Chloro-3-formyl-1h-indole-2-carboxylic acid
CasNumber:
380448-07-7
MolecularFormula:
C10H6ClNO3
MolecularWeight:
223.6125
MdlNumber:
MFCD04966951
Smiles:
O=Cc1c([nH]c2c1cc(Cl)cc2)C(=O)O
Complexity:
284
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(C(=O)N)(OC)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
COC(C(=O)N)(OC)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(CSc1ccccc1C(=O)O)NCc1ccco1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(CSc1ccccc1C(=O)O)NCc1ccco1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(C=C2CCc3c2nc2ccccc2c3C(=O)O)cc(c1OC)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(C=C2CCc3c2nc2ccccc2c3C(=O)O)cc(c1OC)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__