AE98193
18486-69-6 | (-)-Myrtenal
Manufacturer: A2B Chem
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CatalogNumber
AE98193
ChemicalName
(-)-Myrtenal
CasNumber
18486-69-6
MolecularFormula
C10H14O
MolecularWeight
150.21756
MdlNumber
MFCD00074768
Smiles
O=CC1=CC[C@H]2C[C@@H]1C2(C)C
Complexity
225
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
11
HydrogenBondAcceptorCount
1
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AE98193
ChemicalName: (-)-Myrtenal
CasNumber: 18486-69-6
MolecularFormula: C10H14O
MolecularWeight: 150.21756
MdlNumber: MFCD00074768
Smiles: O=CC1=CC[C@H]2C[C@@H]1C2(C)C
Complexity: 225
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AE98193
ChemicalName:
(-)-Myrtenal
CasNumber:
18486-69-6
MolecularFormula:
C10H14O
MolecularWeight:
150.21756
MdlNumber:
MFCD00074768
Smiles:
O=CC1=CC[C@H]2C[C@@H]1C2(C)C
Complexity:
225
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: c1ccc(cc1)C(n1cncc1)(c1ccccc1)c1ccccc1
Complexity: 330
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 4.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
c1ccc(cc1)C(n1cncc1)(c1ccccc1)c1ccccc1
Complexity:
330
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
4.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)Nc1snc(n1)CC(=O)OC
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)Nc1snc(n1)CC(=O)OC
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC1=Cc2c(C1)c(ccc2)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC1=Cc2c(C1)c(ccc2)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__