AA50109
137081-41-5 | 1-Fluorocyclopropane-1-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA50109
ChemicalName
1-Fluorocyclopropane-1-carboxylic acid
CasNumber
137081-41-5
MolecularFormula
C4H5FO2
MolecularWeight
104.0797
MdlNumber
MFCD18205954
Smiles
OC(=O)C1(F)CC1
Complexity
106
Covalently-bondedUnitCount
1
HeavyAtomCount
7
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.5
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CatalogNumber: AA50109
ChemicalName: 1-Fluorocyclopropane-1-carboxylic acid
CasNumber: 137081-41-5
MolecularFormula: C4H5FO2
MolecularWeight: 104.0797
MdlNumber: MFCD18205954
Smiles: OC(=O)C1(F)CC1
Complexity: 106
Covalently-bondedUnitCount: 1
HeavyAtomCount: 7
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.5
CatalogNumber:
AA50109
ChemicalName:
1-Fluorocyclopropane-1-carboxylic acid
CasNumber:
137081-41-5
MolecularFormula:
C4H5FO2
MolecularWeight:
104.0797
MdlNumber:
MFCD18205954
Smiles:
OC(=O)C1(F)CC1
Complexity:
106
Covalently-bondedUnitCount:
1
HeavyAtomCount:
7
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.5
CatalogNumber: AA50115
ChemicalName: Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetate
CasNumber: 137076-54-1
MolecularFormula: C28H52N4O8
MolecularWeight: 572.7345
MdlNumber: MFCD02259697
Smiles: OC(=O)CN1CCN(CCN(CCN(CC1)CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C
Complexity: 799
Covalently-bondedUnitCount: 1
HeavyAtomCount: 40
HydrogenBondAcceptorCount: 12
HydrogenBondDonorCount: 1
RotatableBondCount: 14
Xlogp3: 0.2
CatalogNumber:
AA50115
ChemicalName:
Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetate
CasNumber:
137076-54-1
MolecularFormula:
C28H52N4O8
MolecularWeight:
572.7345
MdlNumber:
MFCD02259697
Smiles:
OC(=O)CN1CCN(CCN(CCN(CC1)CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C
Complexity:
799
Covalently-bondedUnitCount:
1
HeavyAtomCount:
40
HydrogenBondAcceptorCount:
12
HydrogenBondDonorCount:
1
RotatableBondCount:
14
Xlogp3:
0.2
CatalogNumber: __
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Smiles: CCOC(=O)CN1CCN(CCN(CCN(CC1)CC(=O)OCC)CC(=O)OCC)CC(=O)OCC
Complexity: __
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Smiles:
CCOC(=O)CN1CCN(CCN(CCN(CC1)CC(=O)OCC)CC(=O)OCC)CC(=O)OCC
Complexity:
__
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Smiles: ClCC(=O)NCCC(c1ccccc1)c1ccccc1
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Smiles:
ClCC(=O)NCCC(c1ccccc1)c1ccccc1
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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