AB48235
7540-51-4 | (-)-Beta-citronellol
Manufacturer: A2B Chem
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CatalogNumber
AB48235
ChemicalName
(-)-Beta-citronellol
CasNumber
7540-51-4
MolecularFormula
C10H20O
MolecularWeight
156.2652
MdlNumber
MFCD00063214
Smiles
OCC[C@H](CCC=C(C)C)C
Complexity
112
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
3.2
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CatalogNumber: AB48235
ChemicalName: (-)-Beta-citronellol
CasNumber: 7540-51-4
MolecularFormula: C10H20O
MolecularWeight: 156.2652
MdlNumber: MFCD00063214
Smiles: OCC[C@H](CCC=C(C)C)C
Complexity: 112
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 3.2
CatalogNumber:
AB48235
ChemicalName:
(-)-Beta-citronellol
CasNumber:
7540-51-4
MolecularFormula:
C10H20O
MolecularWeight:
156.2652
MdlNumber:
MFCD00063214
Smiles:
OCC[C@H](CCC=C(C)C)C
Complexity:
112
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
3.2
CatalogNumber: AB48236
ChemicalName: 2-chloro-4-(trifluoromethyl)benzaldehyde
CasNumber: 82096-91-1
MolecularFormula: C8H4ClF3O
MolecularWeight: 208.565
MdlNumber: MFCD04112538
Smiles: O=Cc1ccc(cc1Cl)C(F)(F)F
Complexity: 192
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 2.9
CatalogNumber:
AB48236
ChemicalName:
2-chloro-4-(trifluoromethyl)benzaldehyde
CasNumber:
82096-91-1
MolecularFormula:
C8H4ClF3O
MolecularWeight:
208.565
MdlNumber:
MFCD04112538
Smiles:
O=Cc1ccc(cc1Cl)C(F)(F)F
Complexity:
192
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
2.9
CatalogNumber: AB48237
ChemicalName: 4-Chloro-2-methylbenzhydrazide
CasNumber: 75319-02-7
MolecularFormula: C8H9ClN2O
MolecularWeight: 184.6229
MdlNumber: MFCD03425682
Smiles: NNC(=O)c1ccc(cc1C)Cl
Complexity: 174
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 0.8
CatalogNumber:
AB48237
ChemicalName:
4-Chloro-2-methylbenzhydrazide
CasNumber:
75319-02-7
MolecularFormula:
C8H9ClN2O
MolecularWeight:
184.6229
MdlNumber:
MFCD03425682
Smiles:
NNC(=O)c1ccc(cc1C)Cl
Complexity:
174
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
0.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C[C@H]([C@@H]1[C@H]2CC(=O)C(N2C1=O)C(=O)OCc1ccc(cc1)[N+](=O)[O-])O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C[C@H]([C@@H]1[C@H]2CC(=O)C(N2C1=O)C(=O)OCc1ccc(cc1)[N+](=O)[O-])O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__