AB51962
605-50-5 | Diisopentyl phthalate
Manufacturer: A2B Chem
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CatalogNumber
AB51962
ChemicalName
Diisopentyl phthalate
CasNumber
605-50-5
MolecularFormula
C18H26O4
MolecularWeight
306.3966
MdlNumber
MFCD00127736
Smiles
CC(CCOC(=O)c1ccccc1C(=O)OCCC(C)C)C
NscNumber
17070
Complexity
315
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
4
RotatableBondCount
10
Xlogp3
5.6
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CatalogNumber: AB51962
ChemicalName: Diisopentyl phthalate
CasNumber: 605-50-5
MolecularFormula: C18H26O4
MolecularWeight: 306.3966
MdlNumber: MFCD00127736
Smiles: CC(CCOC(=O)c1ccccc1C(=O)OCCC(C)C)C
NscNumber: 17070
Complexity: 315
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 4
RotatableBondCount: 10
Xlogp3: 5.6
CatalogNumber:
AB51962
ChemicalName:
Diisopentyl phthalate
CasNumber:
605-50-5
MolecularFormula:
C18H26O4
MolecularWeight:
306.3966
MdlNumber:
MFCD00127736
Smiles:
CC(CCOC(=O)c1ccccc1C(=O)OCCC(C)C)C
NscNumber:
17070
Complexity:
315
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
4
RotatableBondCount:
10
Xlogp3:
5.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCc1ccc(cc1)C(=S)N
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCc1ccc(cc1)C(=S)N
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB51964
ChemicalName: H-Aib-OtBu HCl
CasNumber: 84758-81-6
MolecularFormula: C8H18ClNO2
MolecularWeight: 195.687
MdlNumber: MFCD08272284
Smiles: O=C(C(N)(C)C)OC(C)(C)C.Cl
NscNumber: __
Complexity: 156
Covalently-bondedUnitCount: 2
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AB51964
ChemicalName:
H-Aib-OtBu HCl
CasNumber:
84758-81-6
MolecularFormula:
C8H18ClNO2
MolecularWeight:
195.687
MdlNumber:
MFCD08272284
Smiles:
O=C(C(N)(C)C)OC(C)(C)C.Cl
NscNumber:
__
Complexity:
156
Covalently-bondedUnitCount:
2
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1ccc(c(n1)C(=O)O)F
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1ccc(c(n1)C(=O)O)F
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__