1,1-bis(1,1-dimethylethoxy)-N,N,N-trimethylamine

HCID 547712
NotesReactions
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Basic information

CAS
36805-97-7
Standard SMILES
CN(C)C(OC(C)(C)C)OC(C)(C)C
InChIKey
DBNQIOANXZVWIP-UHFFFAOYSA-N
Molecular formula
C11H25NO2
Average molar mass
203.32 g/mol
Monoisotopic mass
203.18852904

Names & identifiers

Preferred name
1,1-bis(1,1-dimethylethoxy)-N,N,N-trimethylamine
IUPAC
N,N-dimethyl-1,1-bis[(2-methylpropan-2-yl)oxy]methanamine
English name
N,N-Dimethylformamide di-tert-butyl acetal
Molecular formula
C11H25NO2
Molecular weight
203.32

Names & synonyms

36805-97-7N,N-Dimethylformamide di-tert-butyl acetal1,1-Bis(1,1-dimethylethoxy)-N,N,N-trimethylamineEINECS 253-222-7DTXSID10190284RefChem:409683DTXCID20112775253-222-71,1-Di-tert-butoxy-N,N-dimethylmethanamine1,1-di-tert-Butoxytrimethylamine[bis(tert-butoxy)methyl]dimethylamineMFCD00015002
Show more names
N,N-Di-tert-butoxytrimethylamineDi-tert-butoxyMethyl-diMethyl-aMineDi-tert-butoxy(dimethylamino)methaneN,N-Dimethyldi-tert-butoxymethanamineN,N-Dimethyldi(tert-butyloxy)methanamine
1,1-Di-tert-butoxy-N,N-dimethylmethylamineN,N-dimethyl-1,1-bis[(2-methylpropan-2-yl)oxy]methanamineMethanamine, 1,1-bis(1,1-dimethylethoxy)-N,N-dimethyl-N,N-dimethylformamide di-t-butyl acetaldi-tert-butoxymethyldimethylaminen,n-dimethylformamidedi-tert-butylacetal1,1-ditert-butoxy-n,n-dimethylmethanamineSCHEMBL134356

Database identifiers

CAS
36805-97-7
PubChem CID
547712
DTXSID
DTXSID10190284
EC Number
253-222-7
Nikkaji
J150.313H

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
21.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
14

Physicochemical properties

Boiling point
56 · 56-57 °C8 mm Hg(lit.)
Density
0.848 g/mL · 0.848 g/mL at 25 °C(lit.)
refractive index
20 · n20/D 1.413(lit.)
Flash point
93 °F · 93 °F
storage temp.
2 · under inert gas (nitrogen or Argon) at 2-8°C
solubility
Miscible with toluene and benzene.

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H226 (98%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 49 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 3 (98%)

Safety data

F
10-21
PPE
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
wgk
3
ridadr
UN 1993 3/PG 3
hs_code
29221990
risk_code
10-36/37/38

Chemistry & industry

Applications · 3 items

UsesReagent used for the preparation of indolizines via intermolecular cyclization of picolinium salts.

UsesN,N-Dimethylformamide di-tert-butyl acetal may be used in the synthesis of following:(S)-2-(1-tert-butoxycarbonyl-2-{4-[2-(5-methyl-2-phenyloxazol-4-yl)ethoxy]phenyl}ethylamino)benzoic acid methyl ester3-O-tert-butylmorphinetert-butylesters of pyrrole- and indolecarboxylic acids

General DescriptionN,N-Dimethylformamide di-tert-butyl acetal is an derivatizing reagent.

Upstream & downstream products

Suppliers100 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
南京林叶化学试剂有限公司13376084917 13376082704 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

Related reactions

108 records
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Compound notes

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