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tert-Butyl (aminooxy)acetate

HCID 12919121
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
56834-02-7
Standard SMILES
CC(C)(C)OC(=O)CON
InChIKey
MXJGKTHZWIGRJG-UHFFFAOYSA-N
Molecular formula
C6H13NO3
Average molar mass
147.17 g/mol
Monoisotopic mass
147.08954328

Names & identifiers

Preferred name
tert-Butyl (aminooxy)acetate
IUPAC
tert-butyl 2-aminooxyacetate
English name
Tert-butyl 2-(aMinooxy)acetate
Molecular formula
C6H13NO3
Molecular weight
147.17

Names & synonyms

56834-02-7tert-butyl (aminooxy)acetateDTXSID70512943RefChem:383078DTXCID80463750tert-Butyl 2-(aminooxy)acetatetert-butyl 2-aminooxyacetateMFCD22376565t-Butyl 2-aminoxyacetatet-butyl 2-aminooxyacetatet-butoxycarbonylmethoxyamineRB3106
Show more names
tert-Butyl 2-(aminooxy)tert-Butyl 2-aminoxyacetate2-Methyl-2-propanyl (aminooxy)acetateAcetic acid, (aMinooxy)-, 1,1-diMethylethyl esterAcetic acid, 2-(aminooxy)-, 1,1-dimethylethyl ester
CS-0187667EN300-341553AM62719O-(tert-butoxycarbonylmethyl)hydroxylaminetert-butyl aminooxyacetatetert-butyl(aminooxy)acetateA851891tert-butoxycarbonylmethoxyamine

Database identifiers

CAS
56834-02-7
PubChem CID
12919121
DTXSID
DTXSID70512943
EC Number
884-766-9

Properties

Computed structural properties

XLogP
0.2
Topological polar surface area
61.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
10
Formal charge
0
Complexity
117

Physicochemical properties

Boiling point
210 ℃ · 210℃
Density
1.042 · 1.042
Flash point
77 ℃ · 77℃
storage temp.
2 · under inert gas (nitrogen or Argon) at 2–8 °C
pka
3.03 · 3.03±0.70(Predicted)
Appearance
Colorless to light yellow Liquid
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers34 total

毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Aladdin Scientific[email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
ChemeGen 中国18818260767 · [email protected]
Shanghai Witofly Chemical Co.,Ltd[email protected]
上海威芬奇医药科技有限公司13817485796 · [email protected]
百益化学(连云港)有限公司18552648286 · [email protected]
北京汇科盈生物科技有限公司15210661751 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
上海天习化工有限公司021-20960837,QQ1332204249 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]

Related reactions

54 records
New reaction record
HRID 177985 reaction equation
HRID 177985As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 215074 reaction equation
HRID 215074As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 261662 reaction equation
HRID 261662As reactantuspto-grants-1979_08
HRID 314921 reaction equation
HRID 314921As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 328450 reaction equation
HRID 328450As productuspto-grants-1977_04
HRID 330946 reaction equation
HRID 330946As reactantuspto-grants-2014_11
HRID 358082 reaction equation
HRID 358082As reactantuspto-grants-1984_08
HRID 414866 reaction equation
HRID 414866As productuspto-grants-1988_12
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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
药明览博(武汉)化学科技有限公司
022-59987777 13552403979 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
上海玉函化工有限公司021-61469567 13774476675 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
艾览(上海)化工科技有限公司400-668-9898 · [email protected]
Zjartspharm Co., Ltd15068876005 · [email protected]
成都圣美凯生物科技有限公司028-85157043 15882256948 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
南京司凡克化工有限公司025-58699658 13814094318 · [email protected]
常州新星联生物科技有限公司+86-0519-85551759 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
四川铂友生物科技有限公司(原四川佰朋)028-65791793 18140026355 · [email protected]
安徽敬同药业股份有限公司13675155016 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
北京偶合科技有限公司13552068683 13522913783 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
河南梦泰医药科技有限公司17634413542 · [email protected]
Golden Pharma Co., Limited+86-18958062155 · [email protected]