AI58075
86885-57-6 | (1R,3S,5S)-Methyl 6-oxabicyclo[3.1.0]hexane-3-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI58075
ChemicalName
(1R,3S,5S)-Methyl 6-oxabicyclo[3.1.0]hexane-3-carboxylate
CasNumber
86885-57-6
MolecularFormula
C7H10O3
MolecularWeight
142.1525
MdlNumber
MFCD25541717
Smiles
COC(=O)[C@@H]1C[C@@H]2[C@H](C1)O2
Complexity
156
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
10
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
0.3
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CatalogNumber: AI58075
ChemicalName: (1R,3S,5S)-Methyl 6-oxabicyclo[3.1.0]hexane-3-carboxylate
CasNumber: 86885-57-6
MolecularFormula: C7H10O3
MolecularWeight: 142.1525
MdlNumber: MFCD25541717
Smiles: COC(=O)[C@@H]1C[C@@H]2[C@H](C1)O2
Complexity: 156
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 0.3
CatalogNumber:
AI58075
ChemicalName:
(1R,3S,5S)-Methyl 6-oxabicyclo[3.1.0]hexane-3-carboxylate
CasNumber:
86885-57-6
MolecularFormula:
C7H10O3
MolecularWeight:
142.1525
MdlNumber:
MFCD25541717
Smiles:
COC(=O)[C@@H]1C[C@@H]2[C@H](C1)O2
Complexity:
156
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
0.3
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Smiles: C=CCc1cc(F)cc(c1)Br
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Smiles:
C=CCc1cc(F)cc(c1)Br
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Smiles: O=C1OCC2(N1)CC2
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O=C1OCC2(N1)CC2
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Smiles: Cc1[nH]c2c(c1Br)ccnc2
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Smiles:
Cc1[nH]c2c(c1Br)ccnc2
Complexity:
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Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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