AG008SDW

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CAS Number	1118-47-4
Catalog Number	AG008SDW(AGN-PC-0JKBMP)
Chemical Name	4,4-Dimethylpentanoic acid
IUPAC Name	4,4-dimethylpentanoic acid
InChI	InChI=1S/C7H14O2/c1-7(2,3)5-4-6(8)9/h4-5H2,1-3H3,(H,8,9)
InChI Key	HMMSZUQCCUWXRA-UHFFFAOYSA-N
MDL Number	MFCD00101613
Molecular Formula	C7H14O2
Molecular Weight	130.1849
SMILES	CC(C)(C)CCC(=O)O
Synonyms	4,4-dimethylpentanoic acid, 1118-47-4, Neoheptanoic acid, 4,4-dimethyl-pentanoic acid, Carboxylic acids, C6-8-neo-, Pentanoic acid, 4,4-dimethyl-, 4,4-dimethyl valeric acid, 95823-36-2, AC1L23EN, NCIOpen2_002964, 4,4-dimethyl pentanoic acid, Pentanoicacid,4,4-dimethyl-, Neoheptanoic acid(8CI,9CI), ARONIS23766, SCHEMBL120318, Pentanoic acid,4,4-dimethyl-, ARONIS023871, CTK1C5950, 4,4-DIMETHYLVALERIC ACID, HMMSZUQCCUWXRA-UHFFFAOYSA-N, ALBB-019161, ZINC2039899, 8824AC, BBL022979, LMFA01020144, MFCD00101613, SBB080458, AKOS005111150, MCULE-8929874481, 4,4-dimethylpentanoic acid, AldrichCPR, BS-13107, LS-96087, SC-49427, TR-002321, BB 0260734, FT-0681341, EN300-80467, W-6478, I04-4471, Z1250132455, InChI=1/C7H14O2/c1-7(2,3)5-4-6(8)9/h4-5H2,1-3H3,(H,8,9, C7H14O2, CID14237, NSC65454, C7-H14-O2, FA(7:0), 33113-10-9,

Complexity	100
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	130.099g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	130.187g/mol
Monoisotopic Mass	130.099g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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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