AC89115
98730-77-9 | 1-(Hydroxymethyl)cyclopropanecarbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AC89115
ChemicalName
1-(Hydroxymethyl)cyclopropanecarbonitrile
CasNumber
98730-77-9
MolecularFormula
C5H7NO
MolecularWeight
97.11518
MdlNumber
MFCD11042632
Smiles
OCC1(CC1)C#N
Complexity
117
Covalently-bondedUnitCount
1
HeavyAtomCount
7
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
-0.4
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CatalogNumber: AC89115
ChemicalName: 1-(Hydroxymethyl)cyclopropanecarbonitrile
CasNumber: 98730-77-9
MolecularFormula: C5H7NO
MolecularWeight: 97.11518
MdlNumber: MFCD11042632
Smiles: OCC1(CC1)C#N
Complexity: 117
Covalently-bondedUnitCount: 1
HeavyAtomCount: 7
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: -0.4
CatalogNumber:
AC89115
ChemicalName:
1-(Hydroxymethyl)cyclopropanecarbonitrile
CasNumber:
98730-77-9
MolecularFormula:
C5H7NO
MolecularWeight:
97.11518
MdlNumber:
MFCD11042632
Smiles:
OCC1(CC1)C#N
Complexity:
117
Covalently-bondedUnitCount:
1
HeavyAtomCount:
7
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
-0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C=CCNCC#Cc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C=CCNCC#Cc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(CC(CC(OS(=O)(=O)c1ccccc1)C)C)CC(CC(CC(CC(CC(C)C)C)C)C)C.[NH4+]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(CC(CC(OS(=O)(=O)c1ccccc1)C)C)CC(CC(CC(CC(CC(C)C)C)C)C)C.[NH4+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AC89122
ChemicalName: 1-Benzyl-piperidin-4-one oxime
CasNumber: 949-69-9
MolecularFormula: C12H16N2O
MolecularWeight: 204.2682
MdlNumber: MFCD00277794
Smiles: ON=C1CCN(CC1)Cc1ccccc1
Complexity: 212
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.5
CatalogNumber:
AC89122
ChemicalName:
1-Benzyl-piperidin-4-one oxime
CasNumber:
949-69-9
MolecularFormula:
C12H16N2O
MolecularWeight:
204.2682
MdlNumber:
MFCD00277794
Smiles:
ON=C1CCN(CC1)Cc1ccccc1
Complexity:
212
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.5