AB49891
49701-11-3 | 8-Chlorochroman-4-one
Manufacturer: A2B Chem
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CatalogNumber
AB49891
ChemicalName
8-Chlorochroman-4-one
CasNumber
49701-11-3
MolecularFormula
C9H7ClO2
MolecularWeight
182.6037
MdlNumber
MFCD03695451
Smiles
O=C1CCOc2c1cccc2Cl
Complexity
193
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
Xlogp3
2
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CatalogNumber: AB49891
ChemicalName: 8-Chlorochroman-4-one
CasNumber: 49701-11-3
MolecularFormula: C9H7ClO2
MolecularWeight: 182.6037
MdlNumber: MFCD03695451
Smiles: O=C1CCOc2c1cccc2Cl
Complexity: 193
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
Xlogp3: 2
CatalogNumber:
AB49891
ChemicalName:
8-Chlorochroman-4-one
CasNumber:
49701-11-3
MolecularFormula:
C9H7ClO2
MolecularWeight:
182.6037
MdlNumber:
MFCD03695451
Smiles:
O=C1CCOc2c1cccc2Cl
Complexity:
193
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
Xlogp3:
2
CatalogNumber: AB49892
ChemicalName: Methyl 2-amino-6-bromobenzoate
CasNumber: 135484-78-5
MolecularFormula: C8H8BrNO2
MolecularWeight: 230.0586
MdlNumber: MFCD11977360
Smiles: COC(=O)c1c(N)cccc1Br
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
Xlogp3: 2.3
CatalogNumber:
AB49892
ChemicalName:
Methyl 2-amino-6-bromobenzoate
CasNumber:
135484-78-5
MolecularFormula:
C8H8BrNO2
MolecularWeight:
230.0586
MdlNumber:
MFCD11977360
Smiles:
COC(=O)c1c(N)cccc1Br
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
Xlogp3:
2.3
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Smiles: c1ccc(cc1)CN1CCC2(C1)CNC2
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Smiles:
c1ccc(cc1)CN1CCC2(C1)CNC2
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Smiles: Nc1nc[nH]c2-c1ncc2
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Smiles:
Nc1nc[nH]c2-c1ncc2
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HydrogenBondAcceptorCount:
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Xlogp3:
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