AE80633
194920-62-2 | Boc-TOTA
Manufacturer: A2B Chem
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CatalogNumber
AE80633
ChemicalName
Boc-TOTA
CasNumber
194920-62-2
MolecularFormula
C15H32N2O5
MolecularWeight
320.42498
MdlNumber
MFCD04973133
Smiles
NCCCOCCOCCOCCCNC(=O)OC(C)(C)C
Complexity
269
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
15
Xlogp3
0.3
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CatalogNumber: AE80633
ChemicalName: Boc-TOTA
CasNumber: 194920-62-2
MolecularFormula: C15H32N2O5
MolecularWeight: 320.42498
MdlNumber: MFCD04973133
Smiles: NCCCOCCOCCOCCCNC(=O)OC(C)(C)C
Complexity: 269
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 15
Xlogp3: 0.3
CatalogNumber:
AE80633
ChemicalName:
Boc-TOTA
CasNumber:
194920-62-2
MolecularFormula:
C15H32N2O5
MolecularWeight:
320.42498
MdlNumber:
MFCD04973133
Smiles:
NCCCOCCOCCOCCCNC(=O)OC(C)(C)C
Complexity:
269
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
15
Xlogp3:
0.3
CatalogNumber: AE80634
ChemicalName: 1-Bromo-4-chloro-2,5-difluorobenzene
CasNumber: 172921-33-4
MolecularFormula: C6H2BrClF2
MolecularWeight: 227.43388639999998
MdlNumber: MFCD09878116
Smiles: Fc1cc(Br)c(cc1Cl)F
Complexity: 122
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.4
CatalogNumber:
AE80634
ChemicalName:
1-Bromo-4-chloro-2,5-difluorobenzene
CasNumber:
172921-33-4
MolecularFormula:
C6H2BrClF2
MolecularWeight:
227.43388639999998
MdlNumber:
MFCD09878116
Smiles:
Fc1cc(Br)c(cc1Cl)F
Complexity:
122
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.4
CatalogNumber: AE80635
ChemicalName: 2-Fluoro-3-(trifluoromethyl)phenylacetic acid
CasNumber: 194943-83-4
MolecularFormula: C9H6F4O2
MolecularWeight: 222.1364
MdlNumber: MFCD00061185
Smiles: OC(=O)Cc1cccc(c1F)C(F)(F)F
Complexity: 239
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AE80635
ChemicalName:
2-Fluoro-3-(trifluoromethyl)phenylacetic acid
CasNumber:
194943-83-4
MolecularFormula:
C9H6F4O2
MolecularWeight:
222.1364
MdlNumber:
MFCD00061185
Smiles:
OC(=O)Cc1cccc(c1F)C(F)(F)F
Complexity:
239
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1c(Cl)ccc(c1C(=O)O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1c(Cl)ccc(c1C(=O)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__