AA62793
14064-13-2 | (1-Methylcyclohexyl)methanol
Manufacturer: A2B Chem
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CatalogNumber
AA62793
ChemicalName
(1-Methylcyclohexyl)methanol
CasNumber
14064-13-2
MolecularFormula
C8H16O
MolecularWeight
128.212
MdlNumber
MFCD00270318
Smiles
OCC1(C)CCCCC1
Complexity
82.6
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
2.3
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CatalogNumber: AA62793
ChemicalName: (1-Methylcyclohexyl)methanol
CasNumber: 14064-13-2
MolecularFormula: C8H16O
MolecularWeight: 128.212
MdlNumber: MFCD00270318
Smiles: OCC1(C)CCCCC1
Complexity: 82.6
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.3
CatalogNumber:
AA62793
ChemicalName:
(1-Methylcyclohexyl)methanol
CasNumber:
14064-13-2
MolecularFormula:
C8H16O
MolecularWeight:
128.212
MdlNumber:
MFCD00270318
Smiles:
OCC1(C)CCCCC1
Complexity:
82.6
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.3
CatalogNumber: AA62794
ChemicalName: Diethyl chloromalonate
CasNumber: 14064-10-9
MolecularFormula: C7H11ClO4
MolecularWeight: 194.6128
MdlNumber: MFCD00009140
Smiles: CCOC(=O)C(C(=O)OCC)Cl
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 6
UndefinedAtomStereocenterCount: __
Xlogp3: 1.6
CatalogNumber:
AA62794
ChemicalName:
Diethyl chloromalonate
CasNumber:
14064-10-9
MolecularFormula:
C7H11ClO4
MolecularWeight:
194.6128
MdlNumber:
MFCD00009140
Smiles:
CCOC(=O)C(C(=O)OCC)Cl
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
6
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=CC=C(c1ccc(cc1)Br)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=CC=C(c1ccc(cc1)Br)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1NC(=O)CC1=Cc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1NC(=O)CC1=Cc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__