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Details

Stereochemistry ACHIRAL
Molecular Formula C4H9NO2
Molecular Weight 103.1198
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TERT-BUTYL NITRITE

SMILES

CC(C)(C)ON=O

InChI

InChIKey=IOGXOCVLYRDXLW-UHFFFAOYSA-N
InChI=1S/C4H9NO2/c1-4(2,3)7-5-6/h1-3H3

HIDE SMILES / InChI
Molecular Formula C4H9NO2
Molecular Weight 103.1198
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
139594
PubMed

PubMed

TitleDatePubMed
One-pot synthesis of lactams from cycloalkanes and tert-butyl nitrite by using N-hydroxyphthalimide as key catalyst.
2006 Nov 20
Vibrational analysis of n-butyl, isobutyl, sec-butyl and tert-butyl nitrite.
2007 May
First iron-catalyzed synthesis of oximes from styrenes.
2009 Apr 21
Gas-phase fragmentation of long-lived cysteine radical cations formed via NO loss from protonated S-nitrosocysteine.
2009 Jun
Chemoselective nitration of phenols with tert-butyl nitrite in solution and on solid support.
2009 Sep 17
Patents

Patents

04329518
1
04617316
2
04698093
3
04797149
3
04830664
1
04921530
1
04994103
1
05104994
1
05132420
7
05151512
7
05192758
1
05240920
7
05451594
1
05541177
1
05624925
1
05952362
2
05998466
3
06150521
2
06239131
1
06252061
1
06333296
1
06383986
4
06403575
1
06828321
1
06858639
1
06875765
4
07084170
1
07105530
1
07157487
1
07189718
1
07378525
1
07417041
2
07456185
1
07482349
1
07514463
2
07544707
26
07612105
1
07663001
3
07728029
2
07745641
2
07858781
2
07928248
3
07943767
2
07981919
2
08067592
1
08101634
3
08114846
1
08158640
1
08207331
2
08242104
2
08299063
2
Substance Class Chemical
Created
by admin
on Fri Dec 15 20:16:38 GMT 2023
Edited
by admin
on Fri Dec 15 20:16:38 GMT 2023
Record UNII
4780H7U8LU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TERT-BUTYL NITRITE
MI  
Systematic Name English
TERT-BUTYL NITRITE [MI]
Common Name English
NITROUS ACID, TERT-BUTYL ESTER
Common Name English
.ALPHA.,.ALPHA.-DIMETHYLETHYL NITRITE
Systematic Name English
NITROUS ACID, 1,1-DIMETHYLETHYL ESTER
Common Name English
NITROUS ACID 1,1-DIMETHYL ETHYL ESTER
Common Name English
NITROUS ACID TERT-BUTYL ESTER
Systematic Name English
1,1-DIMETHYLETHYL NITRITE
Systematic Name English
Code System Code Type Description
PUBCHEM
10906
Created by admin on Fri Dec 15 20:16:38 GMT 2023 , Edited by admin on Fri Dec 15 20:16:38 GMT 2023
PRIMARY
CAS
540-80-7
Created by admin on Fri Dec 15 20:16:38 GMT 2023 , Edited by admin on Fri Dec 15 20:16:38 GMT 2023
PRIMARY
FDA UNII
4780H7U8LU
Created by admin on Fri Dec 15 20:16:38 GMT 2023 , Edited by admin on Fri Dec 15 20:16:38 GMT 2023
PRIMARY
EPA CompTox
DTXSID10202316
Created by admin on Fri Dec 15 20:16:38 GMT 2023 , Edited by admin on Fri Dec 15 20:16:38 GMT 2023
PRIMARY
ECHA (EC/EINECS)
208-757-0
Created by admin on Fri Dec 15 20:16:38 GMT 2023 , Edited by admin on Fri Dec 15 20:16:38 GMT 2023
PRIMARY
MERCK INDEX
m2856
Created by admin on Fri Dec 15 20:16:38 GMT 2023 , Edited by admin on Fri Dec 15 20:16:38 GMT 2023
PRIMARY Merck Index
NIH
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