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Ethyl 5-amino-2-methyl-1,3-oxazole-4-carboxylate

HCID 414072
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
3357-54-8
Standard SMILES
CCOC(=O)c1nc(C)oc1N
InChIKey
YXSJNIOOEQDYNO-UHFFFAOYSA-N
Molecular formula
C7H10N2O3
Average molar mass
170.17 g/mol
Monoisotopic mass
170.06914219

Names & identifiers

Preferred name
Ethyl 5-amino-2-methyl-1,3-oxazole-4-carboxylate
IUPAC
ethyl 5-amino-2-methyl-1,3-oxazole-4-carboxylate
English name
ETHYL 5-AMINO-2-METHYLOXAZOLE-4-CARBOXYLATE
Molecular formula
C7H10N2O3
Molecular weight
170.17

Names & synonyms

ethyl 5-amino-2-methyl-1,3-oxazole-4-carboxylateRefChem:595659820-357-3ETHYL 5-AMINO-2-METHYLOXAZOLE-4-CARBOXYLATE3357-54-8MFCD099535755-AMINO-2-METHYL-OXAZOLE-4-CARBOXYLIC ACID ETHYL ESTER4-OXAZOLECARBOXYLICACID, 5-AMINO-2-METHYL-, ETHYL ESTERNSC54757ethyl 5-amino-2-methyl-oxazole-4-carboxylateETHYL5-AMINO-2-METHYLOXAZOLE-4-CARBOXYLATESCHEMBL361590
Show more names
DTXSID50328802YXSJNIOOEQDYNO-UHFFFAOYSA-N2-methyl-4-carbethoxy-5-aminooxazoleAKOS006281178AB55425CCG-321205AS-92785SY185696

Database identifiers

CAS
3357-54-8
PubChem CID
414072
DTXSID
DTXSID50328802
EC Number
820-357-3

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
78.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
12
Formal charge
0
Complexity
174

Physicochemical properties

Melting point
130 · 130-131 °C
Boiling point
272.4 · 272.4±20.0 °C(Predicted)
Density
1.229 · 1.229±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C
pka
1.93 · 1.93±0.10(Predicted)
form
solid
color
Light yellow
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
319 · H319-H335-H302+H312+H332-H315
Precautionary statements
280 · P280-P301+P312-P362+P364
HS Code
2934999090 · 2934999090

Safety & regulation

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

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

hs_code
2934999090
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H319-H335-H302+H312+H332-H315
Precautionary statements
P280-P301+P312-P362+P364

Chemistry & industry

Upstream & downstream products

Upstream raw materials

Ethyl N-acyl-2-chloroglycinateDIETHYLALUMINUM CYANIDE SOLUTIONoxymaEthyl cyanoacetate

Suppliers27 total

西安华瑞致远生物科技有限公司18112972000 · [email protected]
Pure Chemistry Scientific Inc.001-857-928-2050 or 1-888-588-9418 · [email protected]
武汉艾瑞尔化学科技有限公司18986259541 18986259541 · [email protected]
南京诺利斯医药科技有限公司13901585132 · [email protected]
赛纳斯特化学(欢迎点击联系)021-60343070
武汉凯美克化学科技有限公司027-87342388 18086026008 · [email protected]
南通敏言生物医药科技有限公司0513-85921823 18662920231 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
山东集润生物医药科技有限公司0539-0539-8613587 17661611089 · [email protected]
江苏倍达医药科技有限公司0512-63009836 18994340901 · [email protected]
上海昭昀生物科技有限公司19983777532 · [email protected]
韶远科技(上海)有限公司4000665055 · [email protected]
杰达维(上海)医药科技发展有限公司/J & W PharmLab021-64340559 13651849907 · [email protected]
郑州阿尔法化工有限公司0371-53765687 18937137882 · [email protected]
上海思言生物科技有限公司021-50908862,442785678,326799392 18721037013 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
上海康曼生物科技有限公司18800375331 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
聿锦(天津)科技有限公司13370351217 kungfu1217@1 · [email protected]
诺圣华控股集团有限公司+86-023-62871537 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
广东翁江化学试剂有限公司0751-2815983 13927872582 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
南通普悦生物医药有限公司0513-0513-0513-89158300 18014392889 · [email protected]
上海博拓生物科技有限公司16621358918 · [email protected]

Related reactions

2 records
New reaction record
HRID 1121551 reaction equation
HRID 1121551As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1702183 reaction equation
HRID 1702183As reactantuspto-grants-1983_04

Compound notes

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