AG00017Y

1002-84-2 | Pentadecanoic acid

AG00017Y

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CAS Number	1002-84-2
Catalog Number	AG00017Y(AGN-PC-073YW5)
Chemical Name	Pentadecanoic acid
EC Number	213-693-1
FEMA Number	4334
IUPAC Name	pentadecanoic acid
InChI	InChI=1S/C15H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17/h2-14H2,1H3,(H,16,17)
InChI Key	WQEPLUUGTLDZJY-UHFFFAOYSA-N
MDL Number	MFCD00002745
Molecular Formula	C15H30O2
Molecular Weight	242.3975
NSC Number	28486
SMILES	C(CCCCCCCC)CCCCCC(=O)O
UNII	CCW02D961F
Synonyms	pentadecanoic acid, PENTADECANOIC ACID, Pentadecylic acid, 1002-84-2, n-Pentadecanoic acid, Pentadecyclic acid, n-Pentadecylic acid, NSC 28486, C15:0, UNII-CCW02D961F, EINECS 213-693-1, MFCD00002745, BRN 1773831, AI3-36441, CCW02D961F, CHEMBL460025, CHEBI:42504, WQEPLUUGTLDZJY-UHFFFAOYSA-N, n-Pentadecanoic acid, 99%, F15, Pentadecyclate, n-Pentadecylate, n-Pentadecanoate, n-Pentadecanoicacid, pentadecansäure, tetradecylcarboxylic acid, tetradecyl carboxylic acid, Pentadecanoic acid, 99%, DSSTox_CID_1652, bmse000558, AC1Q2W1K, SCHEMBL6311, ACMC-1C8J9, DSSTox_RID_76264, DSSTox_GSID_21652, Pentadecanoic acid, >=99%, 4-02-00-01147 (Beilstein Handbook Reference), WLN: QV14, AC1L22M2, DTXSID2021652, CTK0I0293, NSC28486, Tox21_201197, 6303AF, ANW-14209, BDBM50242348, LMFA01010015, NSC-28486, STL453783, ZINC30731069, AKOS015903762, CS-W004283, HY-W004283, MCULE-3630464562, Pentadecanoic acid, analytical standard, NCGC00248954-01, NCGC00258749-01, AK126523, AN-19641, CC-33534, SY009985, CAS-1002-84-2, Pentadecanoic acid, ~99% (capillary GC), AX8146974, BC4157437, LS-101401, RT-000231, FT-0738251, P0035, ST24031513, ST51037413, MFCD00002745 (95%), C16537, 9B1C70C0-EF6E-4FCF-A3D3-DACCDCCF791C, C-33594, J-000083, I14-17597, pentadecanoate, palmitic acid, stearic acid, oleic acid, Unknown Ligand, C15H30O2, CID13849, C15-H30-O2, FA(15:0), (2r)-2,3-Dihydroxypropyl (9z)-Octadec-9-Enoate, C15, OLA, OLC, PLM, STE, UNL,

Complexity	166
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	242.225g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	242.403g/mol
Monoisotopic Mass	242.225g/mol
Rotatable Bond Count	13
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335-H413
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number