AA69056

141942-85-0 | Ethyl (r)-(-)-4-cyano-3-hydroxybutyrate

Manufacturer: A2B Chem

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CatalogNumber

AA69056

ChemicalName

Ethyl (r)-(-)-4-cyano-3-hydroxybutyrate

CasNumber

141942-85-0

MolecularFormula

C7H11NO3

MolecularWeight

157.1671

MdlNumber

MFCD00270839

Smiles

CCOC(=O)C[C@@H](CC#N)O

Complexity

170

Covalently-bondedUnitCount

1

DefinedAtomStereocenterCount

1

HeavyAtomCount

11

HydrogenBondAcceptorCount

4

HydrogenBondDonorCount

1

RotatableBondCount

5

Xlogp3

-0.5

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A2B Chem

AA69056

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CatalogNumber:
AA69056

ChemicalName:
Ethyl (r)-(-)-4-cyano-3-hydroxybutyrate

CasNumber:
141942-85-0

MolecularFormula:
C7H11NO3

MolecularWeight:
157.1671

MdlNumber:
MFCD00270839

Smiles:
CCOC(=O)C[C@@H](CC#N)O

Complexity:
170

Covalently-bondedUnitCount:
1

DefinedAtomStereocenterCount:
1

HeavyAtomCount:
11

HydrogenBondAcceptorCount:
4

HydrogenBondDonorCount:
1

RotatableBondCount:
5

Xlogp3:
-0.5

Img

A2B Chem

AA69059

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
CC(=O)OC1OCCCC1(Cl)Cl

Complexity:
__

Covalently-bondedUnitCount:
__

DefinedAtomStereocenterCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AA69061

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
CC(=O)OC1OCCC1(Cl)Cl

Complexity:
__

Covalently-bondedUnitCount:
__

DefinedAtomStereocenterCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AA69067

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
C1COC2(C1)CCNC2.Cl

Complexity:
__

Covalently-bondedUnitCount:
__

DefinedAtomStereocenterCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__