AA41951
127-47-9 | Vitamin A Acetate
Manufacturer: A2B Chem
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CatalogNumber
AA41951
ChemicalName
Vitamin A Acetate
CasNumber
127-47-9
MolecularFormula
C22H32O2
MolecularWeight
328.4883
MdlNumber
MFCD00019413
Smiles
CC(=O)OC/C=C(/C=C/C=C(/C=C/C1=C(C)CCCC1(C)C)C)C
Complexity
596
Covalently-bondedUnitCount
1
DefinedBondStereocenterCount
4
HeavyAtomCount
24
HydrogenBondAcceptorCount
2
RotatableBondCount
7
Xlogp3
6.3
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CatalogNumber: AA41951
ChemicalName: Vitamin A Acetate
CasNumber: 127-47-9
MolecularFormula: C22H32O2
MolecularWeight: 328.4883
MdlNumber: MFCD00019413
Smiles: CC(=O)OC/C=C(/C=C/C=C(/C=C/C1=C(C)CCCC1(C)C)C)C
Complexity: 596
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 4
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 2
RotatableBondCount: 7
Xlogp3: 6.3
CatalogNumber:
AA41951
ChemicalName:
Vitamin A Acetate
CasNumber:
127-47-9
MolecularFormula:
C22H32O2
MolecularWeight:
328.4883
MdlNumber:
MFCD00019413
Smiles:
CC(=O)OC/C=C(/C=C/C=C(/C=C/C1=C(C)CCCC1(C)C)C)C
Complexity:
596
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
4
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
2
RotatableBondCount:
7
Xlogp3:
6.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC(=O)C=CC1=C(C)CCCC1(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCC(=O)C=CC1=C(C)CCCC1(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)/C=C/C1C(=CCCC1(C)C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)/C=C/C1C(=CCCC1(C)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C/C(=C\C=C\C=C(\C=C\C=C(\C=C\C1=C(C)C[C@H](CC1(C)C)O)/C)/C)/C=C/C=C(/C=C[C@H]1C(=C[C@@H](CC1(C)C)O)C)\C
Complexity: 1270
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 11
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C/C(=C\C=C\C=C(\C=C\C=C(\C=C\C1=C(C)C[C@H](CC1(C)C)O)/C)/C)/C=C/C=C(/C=C[C@H]1C(=C[C@@H](CC1(C)C)O)C)\C
Complexity:
1270
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
11