AF60511
4277-29-6 | Cycloheptanecarbaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AF60511
ChemicalName
Cycloheptanecarbaldehyde
CasNumber
4277-29-6
MolecularFormula
C8H14O
MolecularWeight
126.1962
MdlNumber
MFCD03412495
Smiles
O=CC1CCCCCC1
Complexity
80.6
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
1
RotatableBondCount
1
Xlogp3
2.3
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CatalogNumber: AF60511
ChemicalName: Cycloheptanecarbaldehyde
CasNumber: 4277-29-6
MolecularFormula: C8H14O
MolecularWeight: 126.1962
MdlNumber: MFCD03412495
Smiles: O=CC1CCCCCC1
Complexity: 80.6
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
Xlogp3: 2.3
CatalogNumber:
AF60511
ChemicalName:
Cycloheptanecarbaldehyde
CasNumber:
4277-29-6
MolecularFormula:
C8H14O
MolecularWeight:
126.1962
MdlNumber:
MFCD03412495
Smiles:
O=CC1CCCCCC1
Complexity:
80.6
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [N-]=[N+]=NC(=O)c1cccnc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[N-]=[N+]=NC(=O)c1cccnc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)CC(=O)Cc1cccc(c1)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCOC(=O)CC(=O)Cc1cccc(c1)OC
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
__
CatalogNumber: AF60516
ChemicalName: Methyl 3-(1h-imidazol-4-yl)propanoate
CasNumber: 31434-93-2
MolecularFormula: C7H11ClN2O2
MolecularWeight: 190.6274
MdlNumber: MFCD04039607
Smiles: COC(=O)CCc1c[nH]cn1.Cl
Complexity: 138
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 0.2
CatalogNumber:
AF60516
ChemicalName:
Methyl 3-(1h-imidazol-4-yl)propanoate
CasNumber:
31434-93-2
MolecularFormula:
C7H11ClN2O2
MolecularWeight:
190.6274
MdlNumber:
MFCD04039607
Smiles:
COC(=O)CCc1c[nH]cn1.Cl
Complexity:
138
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
0.2