AG002XQ7

Name: 2,6-Heptanedione, 3-acetyl-
Brand: Angene Chemical
SKU: AG002XQ7

29214-57-1 | 2,6-Heptanedione, 3-acetyl-

AG002XQ7

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CAS Number	29214-57-1
Catalog Number	AG002XQ7(AGN-PC-0JM2ZA)
Chemical Name	2,6-Heptanedione, 3-acetyl-
EC Number	249-517-5
IUPAC Name	3-acetylheptane-2,6-dione
InChI	InChI=1S/C9H14O3/c1-6(10)4-5-9(7(2)11)8(3)12/h9H,4-5H2,1-3H3
InChI Key	RQZJIXZNJBCGQC-UHFFFAOYSA-N
MDL Number	MFCD00048225
Molecular Formula	C9H14O3
Molecular Weight	170.2057
NSC Number	111324
SMILES	CC(CCC(C(C)=O)C(C)=O)=O
Synonyms	3-Acetylheptane-2,6-dione, 29214-57-1, 3-Acetyl-2,6-heptanedione, 2,6-Heptanedione,3-acetyl-, 2,6-Heptanedione, 3-acetyl-, RQZJIXZNJBCGQC-UHFFFAOYSA-N, EINECS 249-517-5, NSC111324, AC1Q5BZS, 3-acetyl-2,6-heptandione, 5-acetyl-2,6-heptanedione, 3-acetyl-heptane-2,6-dione, 3-Acetyl-2,6-heptanedione #, AC1L403U, SCHEMBL1406339, CTK4G2942, DTXSID50183473, KS-000000TM, ZINC4878395, MFCD00048225, AKOS006274591, NSC-111324, ACM29214571, FT-0699598, CID98352, AR-1F1583, C9-H14-O3, 30062-37-4,

Complexity	192
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	170.094g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	170.208g/mol
Monoisotopic Mass	170.094g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	51.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.2

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited