Results for:
PubChem ID: 117801

(2,2-dimethyl-3-nitrooxypropyl) Nitrate

Compound Details

Synonymous names	Neopentyl glycol dinitrate 26482-65-5 1,3-Propanediol, 2,2-dimethyl-, dinitrate Dimethylolpropane dinitrate 1,3-Propanediol, 2,2-dimethyl-, 1,3-dinitrate SCHEMBL9803543 DTXSID20885351 2,2-Dimethyl-1,3-propanediol, dinitrate
Microorganism:	Yes
IUPAC name	(2,2-dimethyl-3-nitrooxypropyl) nitrate
SMILES	CC(C)(CO[N+](=O)[O-])CO[N+](=O)[O-]
Inchi	InChI=1S/C5H10N2O6/c1-5(2,3-12-6(8)9)4-13-7(10)11/h3-4H2,1-2H3
Formula	C5H10N2O6
PubChem ID	117801
Molweight	194.14
LogP	2
Atoms	13
Bonds	4
H-bond Acceptor	6
H-bond Donor	0
Chemical Classification	nitrates nitrogen compounds

mVOC Specific Details

Species emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Meyerozyma Guilliermondii Xiong et al. 2023
Method	Kingdom Species Growth Medium Applied Method Verification Meyerozyma Guilliermondii YEPD, 10 g/L yeast extrac, 20 g/L peptone, 20 g dextrose GC-MS and GC-IMS no