AB43225
73367-80-3 | 12-Bromododecanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB43225
ChemicalName
12-Bromododecanoic acid
CasNumber
73367-80-3
MolecularFormula
C12H23BrO2
MolecularWeight
279.2138
MdlNumber
MFCD00002738
Smiles
BrCCCCCCCCCCCC(=O)O
NscNumber
660375
Complexity
149
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
11
Xlogp3
5
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CatalogNumber: AB43225
ChemicalName: 12-Bromododecanoic acid
CasNumber: 73367-80-3
MolecularFormula: C12H23BrO2
MolecularWeight: 279.2138
MdlNumber: MFCD00002738
Smiles: BrCCCCCCCCCCCC(=O)O
NscNumber: 660375
Complexity: 149
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 11
Xlogp3: 5
CatalogNumber:
AB43225
ChemicalName:
12-Bromododecanoic acid
CasNumber:
73367-80-3
MolecularFormula:
C12H23BrO2
MolecularWeight:
279.2138
MdlNumber:
MFCD00002738
Smiles:
BrCCCCCCCCCCCC(=O)O
NscNumber:
660375
Complexity:
149
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
11
Xlogp3:
5
CatalogNumber: AB43226
ChemicalName: 15-Crown-5
CasNumber: 33100-27-5
MolecularFormula: C10H20O5
MolecularWeight: 220.2628
MdlNumber: MFCD00005110
Smiles: O1CCOCCOCCOCCOCC1
NscNumber: __
Complexity: 86.2
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: -0.5
CatalogNumber:
AB43226
ChemicalName:
15-Crown-5
CasNumber:
33100-27-5
MolecularFormula:
C10H20O5
MolecularWeight:
220.2628
MdlNumber:
MFCD00005110
Smiles:
O1CCOCCOCCOCCOCC1
NscNumber:
__
Complexity:
86.2
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
-0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1CC[C@]2(C(=C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC=C2c1cccnc1)C)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CC[C@]2(C(=C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC=C2c1cccnc1)C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1CCC2(C(=C1)CCC1C2CCC2(C1CCC2(O)C(=O)C)C)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CCC2(C(=C1)CCC1C2CCC2(C1CCC2(O)C(=O)C)C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__