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AI06642

105-21-5 | 4-Heptanolide

Manufacturer: A2B Chem

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CatalogNumber

AI06642

ChemicalName

4-Heptanolide

CasNumber

105-21-5

MolecularFormula

C7H12O2

MolecularWeight

128.169

MdlNumber

MFCD00036498

Smiles

CCCC1CCC(=O)O1

Complexity

110

Covalently-bondedUnitCount

1

HeavyAtomCount

9

HydrogenBondAcceptorCount

2

RotatableBondCount

2

UndefinedAtomStereocenterCount

1

Xlogp3

1.1

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Img

A2B Chem

AI06642

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CatalogNumber:
AI06642
ChemicalName:
4-Heptanolide
CasNumber:
105-21-5
MolecularFormula:
C7H12O2
MolecularWeight:
128.169
MdlNumber:
MFCD00036498
Smiles:
CCCC1CCC(=O)O1
Complexity:
110
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.1

Img

A2B Chem

AI06643

--

CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=COCCC(CCC=C(C)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__

Img

A2B Chem

AI06644

--

CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CCCCCCCCCCCC(=O)OCCO1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__

Img

A2B Chem

AI06645

--

CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#CCc1ccc(cc1[N+](=O)[O-])OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__