AG003IQZ

107-75-5 | 7-Hydroxy-3,7-dimethyloctanal

AG003IQZ

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CAS Number	107-75-5
Catalog Number	AG003IQZ(AGN-PC-0JK8AO)
Chemical Name	7-Hydroxy-3,7-dimethyloctanal
EC Number	203-518-7
FEMA Number	2583
IUPAC Name	7-hydroxy-3,7-dimethyloctanal
InChI	InChI=1S/C10H20O2/c1-9(6-8-11)5-4-7-10(2,3)12/h8-9,12H,4-7H2,1-3H3
InChI Key	WPFVBOQKRVRMJB-UHFFFAOYSA-N
MDL Number	MFCD00014681
Molecular Formula	C10H20O2
Molecular Weight	172.2646
SMILES	OC(CCCC(CC=O)C)(C)C
Synonyms	7-hydroxycitronellal, hydroxycitronellal, Hydroxycitronellal, 7-Hydroxy-3,7-dimethyloctanal, 107-75-5, 7-Hydroxycitronellal, Citronellal hydrate, 3,7-Dimethyl-7-hydroxyoctanal, Phixia, Cyclalia, Cyclosia, Laurine, Fixol, Lilyl aldehyde, Muguet synthetic, Musuet synthetic, Muguettine principle, Musuettine principle, Octanal, 7-hydroxy-3,7-dimethyl-, Citronellal, hydroxy-, hydroxy citronellal, Oxydihydrocitronellal, 7-Hydroxy-3,7-dimethyloctan-1-al, NSC 406740, FEMA No. 2583, CHEBI:53459, 1-OCTANAL, 3,7-DIMETHYL-7-HYDROXY-, EINECS 203-518-7, BRN 1721290, AI3-05823, 7-Hydroxy-3,7-dimethyloctanol, WPFVBOQKRVRMJB-UHFFFAOYSA-N, 3,7-dimethyl-7-hydroxyoctan-1-al, Octanol, 7-hydroxy-3,7-dimethyl-, NCGC00181031-01, DSSTox_CID_22232, DSSTox_RID_79966, DSSTox_GSID_42232, W-108737, CAS-107-75-5, oxy dihydrocitronellal, Octanal,7-dimethyl-, Epitope ID:114090, EC 203-518-7, AC1L1PS6, AC1Q1R1O, SCHEMBL94185, 4-01-00-04058 (Beilstein Handbook Reference), 3,7-Dimethyl-7-hydroxyoctana, GTPL2468, CHEMBL3186027, DTXSID6042232, 7-hydroxy-3,7-dimethyl-octanal, CTK0H5083, FEMA 2583, KS-00000YTN, WLN: VH1Y1&3XQ1&1, 1-Octanal,7-dimethyl-7-hydroxy-, Tox21_112681, Tox21_301174, 5764AF, MFCD00014681, NSC163509, NSC406740, 7-hydroxy-3,7-dimethyl-caprylaldehyde, AKOS015901699, Hydroxycitronellal, analytical standard, 3,7-Dimethyl-7-hydroxyoctanal, 97%, LS-2819, MCULE-5086680455, NSC-163509, NSC-406740, RTR-001858, TRA0088906, Hydroxycitronellal, >=95%, FCC, FG, 7-HYDROXY-3,7-DIMETHYL OCTANAL, NCGC00181031-02, NCGC00181031-03, NCGC00255072-01, AK306843, AN-22487, TR-001858, FT-0627144, SR-01000944842, SR-01000944842-1, 7-Hydroxycitronellal, Odorant used in allergy studies, I14-14687, 7- hydroxycitronellal, UNII-8SQ0VA4YUR, 7 - hydroxycitronellal, 8SQ0VA4YUR, D01PZP, CID7888, C10H20O2, C10-H20-O2, C020755,

Complexity	130
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.146g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	172.268g/mol
Monoisotopic Mass	172.146g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317
Packing Group
Precautionary statements	P261-P280
UN Code

Certificate of Analysis

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