AG0037ZA

106-72-9 | 2,6-Dimethylhept-5-enal

AG0037ZA

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CAS Number	106-72-9
Catalog Number	AG0037ZA(AGN-PC-0JL483)
Chemical Name	2,6-Dimethylhept-5-enal
EC Number	203-427-2
FEMA Number	2389
IUPAC Name	2,6-dimethylhept-5-enal
InChI	InChI=1S/C9H16O/c1-8(2)5-4-6-9(3)7-10/h5,7,9H,4,6H2,1-3H3
InChI Key	YGFGZTXGYTUXBA-UHFFFAOYSA-N
MDL Number	MFCD00006981
Molecular Formula	C9H16O
Molecular Weight	140.2227
NSC Number	78450
SMILES	CC(C=O)CCC=C(C)C
Synonyms	2,6-dimethyl-5-heptenal, 2,6-dimethylhept-5-en-1-al, 2,6-DMH, dimethyl heptenal, 2,6-Dimethyl-5-heptenal, 2,6-Dimethylhept-5-enal, 106-72-9, Melonal, 5-HEPTENAL, 2,6-DIMETHYL-, Bergamal, 2,6-Dimethyl-5-hepten-1-al, 2,6-Dimethyl-5-heptanal, 2,6-Dimethylhept-5-en-1-al, FEMA No. 2389, 2,6-Dimethyl-2-hepten-7-al, 2,6-Dimethyl-5-heptenal (natural), EINECS 203-427-2, NSC 78450, BRN 1745855, AI3-33278, YGFGZTXGYTUXBA-UHFFFAOYSA-N, MFCD00006981, melon heptenal, 5-Heptenal,6-dimethyl-, AC1L1UD0, AC1Q1R0H, AC1Q1R0I, ACMC-1BE55, DSSTox_CID_24753, DSSTox_RID_80446, DSSTox_GSID_44753, SCHEMBL29785, 4-01-00-03508 (Beilstein Handbook Reference), 2-Formyl-6-methylhept-5-ene, Jsp000598, CHEMBL3184983, DTXSID8044753, 2,6-dimethyl hept-5-en-1-al, CTK3J5156, NSC78450, ZX-AT011266, (+/-)-2,6-Dimethyl-5-heptenal, Tox21_300941, ANW-15430, LMFA06000127, NSC-78450, OR6019, AKOS015901999, FCH1115552, LS-2685, MCULE-6765236802, NCGC00248220-01, NCGC00254843-01, AN-22445, BP-10922, CAS-106-72-9, CC-08168, SC-79180, 2,6-DIMETHYL-5-HEPTEN-1-AL FCC, 2,6-Dimethyl-5-heptenal, stabilized, FCC, AX8068454, DB-003243, RT-002370, D1413, FT-0631595, 2,6-DIMETHYL-5-HEPTEN-1-AL, 85%, 2,6-Dimethyl-5-heptenal, technical grade, 80%, C-30869, J-001636, I14-13313, 2,6-Dimethyl-5-heptenal, mixture of isomers, natural, 97%, FG, 77787-60-1, Melonorg, UNII-Z331YX9EL9, 2,6-DIMETHYLPYRAZINE, 5-heptenal, 2,6-dimetil-, C9H16O, Z331YX9EL9, C9-H16-O, CID61016, 2,6 - dimethylhept - 5 - enal, 2,6-Dimethyl-5-heptenal, 97% - 100ML 100ml,

Complexity	121
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	140.12g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	140.226g/mol
Monoisotopic Mass	140.12g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number