AC94704
6952-89-2 | (4-Bromophenyl)(cyclopropyl)methanone
Manufacturer: A2B Chem
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CatalogNumber
AC94704
ChemicalName
(4-Bromophenyl)(cyclopropyl)methanone
CasNumber
6952-89-2
MolecularFormula
C10H9BrO
MolecularWeight
225.08186000000003
MdlNumber
MFCD00019227
Smiles
O=C(c1ccc(cc1)Br)C1CC1
NscNumber
70846
Complexity
178
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
1
RotatableBondCount
2
Xlogp3
2.9
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CatalogNumber: AC94704
ChemicalName: (4-Bromophenyl)(cyclopropyl)methanone
CasNumber: 6952-89-2
MolecularFormula: C10H9BrO
MolecularWeight: 225.08186000000003
MdlNumber: MFCD00019227
Smiles: O=C(c1ccc(cc1)Br)C1CC1
NscNumber: 70846
Complexity: 178
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 1
RotatableBondCount: 2
Xlogp3: 2.9
CatalogNumber:
AC94704
ChemicalName:
(4-Bromophenyl)(cyclopropyl)methanone
CasNumber:
6952-89-2
MolecularFormula:
C10H9BrO
MolecularWeight:
225.08186000000003
MdlNumber:
MFCD00019227
Smiles:
O=C(c1ccc(cc1)Br)C1CC1
NscNumber:
70846
Complexity:
178
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
1
RotatableBondCount:
2
Xlogp3:
2.9
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Smiles: CC(=O)OC1(CCCCC1)CCC1CCCCC1
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CC(=O)OC1(CCCCC1)CCC1CCCCC1
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Smiles: CCCCCCCCCCCCCO[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O[C@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O
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CCCCCCCCCCCCCO[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O[C@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O
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Smiles: OC[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1OC)O)O)n1c2c(Cl)cccc2c2c1c1[nH]c3c(c1c1c2C(=O)NC1=O)cccc3Cl
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Smiles:
OC[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1OC)O)O)n1c2c(Cl)cccc2c2c1c1[nH]c3c(c1c1c2C(=O)NC1=O)cccc3Cl
NscNumber:
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Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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