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5-Cyclopropyl-1,3,4-oxadiazol-2-amine

HCID 16767787
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
89179-60-2
Standard SMILES
Nc1nnc(C2CC2)o1
InChIKey
BXHGGEZILMHEAM-UHFFFAOYSA-N
Molecular formula
C5H7N3O
Average molar mass
125.13 g/mol
Monoisotopic mass
125.05891186

Names & identifiers

Preferred name
5-Cyclopropyl-1,3,4-oxadiazol-2-amine
IUPAC
5-cyclopropyl-1,3,4-oxadiazol-2-amine
English name
5-Cyclopropyl-1,3,4-oxadiazol-2-amine
Molecular formula
C5H7N3O
Molecular weight
125.13

Names & synonyms

5-cyclopropyl-1,3,4-oxadiazol-2-amine89179-60-2DTXSID00588015RefChem:302747DTXCID20538779857-651-6MFCD090411792-Amino-5-cyclopropyl-1,3,4-oxadiazol5-Cyclopropyl-[1,3,4]oxadiazol-2-ylamineSCHEMBL1924555AKOS000123461CS-W011175
Show more names
(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amine2-Amino-5-cyclopropyl-1,3,4-oxadiazol - [A12275]5-cyclopropyl-1,3,4-oxadiazol-2-amine(SALTDATA: FREE)
PB343571,3,4-OXADIAZOL-2-AMINE, 5-CYCLOPROPYL-F2182-01202243AF2-Amino-5-cyclopropyl-1SMSSF-0018141ALBB-0106972-Amino-5-cyclopropyl-1,3,4-oxadiazole

Database identifiers

CAS
89179-60-2
PubChem CID
16767787
DTXSID
DTXSID00588015
EC Number
107-052-4、857-651-6

Properties

Computed structural properties

XLogP
-0.7
Topological polar surface area
64.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
9
Formal charge
0
Complexity
115

Physicochemical properties

Boiling point
282 ℃ · 282℃
Density
1.406 · 1.406
Flash point
124 ℃ · 124℃
storage temp.
2 · 2-8°C, protect from light
pka
-0.58 · -0.58±0.13(Predicted)
form
solid
Appearance
Off-white to yellow Solid
InChI
1S/C5H7N3O/c6-5-8-7-4(9-5)3-1-2-3/h3H,1-2H2,(H2,6,8)
InChIKey
BXHGGEZILMHEAM-UHFFFAOYSA-N
SMILES
NC1=NN=C(C2CC2)O1
UNSPSC Code
12352116 · 12352116
Symbol(GHS)
6 · GHS06
Signal word
Danger
Hazard statements
301 · H301
Precautionary statements
301 · P301+P310
Hazard Codes
T
Risk Statements
25 · 25
Safety Statements
45 · 45
RIDADR
2811 · UN 2811 6.1 / PGIII
HazardClass
IRRITANT
HS Code
2934999090 · 2934999090
Storage Class
6.1 C · 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
Hazard Classifications
3 Oral · Acute Tox. 3 Oral

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 · 6 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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 Categories · 2 items

Acute Tox. 4 (100%);Skin Irrit. 2 (100%);Eye Irrit. 2A (100%);STOT SE 3 (100%)

Acute Tox. 3 (100%)

Safety data

ridadr
UN 2811 6.1 / PGIII
hs_code
2934999090
risk_code
25
Signal word
Danger
Symbol(GHS)
GHS06
hazard_code
T
safety_code
45
hazard_class
IRRITANT
Storage Class
6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
Hazard statements
H301
Hazard Classifications
Acute Tox. 3 Oral
Precautionary statements
P301+P310

Chemistry & industry

Applications

Uses5-Cyclopropyl-1,3,4-oxadiazol-2-amine has been demonstated to lower in blood sugar of mammals such as rats and dogs.

Suppliers47 total

上海康恩博医药科技有限公司17510465506 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
上海海皋科技有限公司021-57646680 18306277365 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
南京药石科技股份有限公司4000255188 · [email protected]
上海常丰生物医药科技有限公司+86-021-61727342 13611721451 · [email protected]
台州南峰药物研究所[email protected] 18616377689 · [email protected]
上海裕兰生物科技有限公司021-57171705 13817537615 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
武汉海昕药物研究有限公司027-81525288 18086100502 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
上海超岚化工科技中心(原宁波市超明生物科技有限公司)13301662590 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
盐城康迪森医药科技有限公司13812573443;18052965989 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
湖北威德利化学试剂有限公司15871722230 · [email protected]
上海瀚思化工有限公司17717618050 · [email protected]
成都华纯科技有限公司400-1166-196 15982826727 · [email protected]
无锡东禾医药科技有限公司63313187 15358055255 · [email protected]
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
上海臻励生物科技有限公司021-16621358918; 18516310516;16621358918;13045646768 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
南京合巨药业有限公司025-57027686 17372956142 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
Aladdin Scientific[email protected]
北京珐默兹医药科技有限公司15811073878 · [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]
砌块化学科技(上海)有限公司021-20432219 13918097649 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 18917919676 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海传芊化工科技中心15869524721 · [email protected]
南京药石科技股份有限公司4000255188 · [email protected]
泰兴市海川生物科技有限公司19353112242 · [email protected]

Related reactions

8 records
New reaction record
HRID 392732 reaction equation
HRID 392732As reactantuspto-grants-2004_10
HRID 392733 reaction equation
HRID 392733As reactantuspto-grants-2004_10
HRID 807477 reaction equation
HRID 807477As reactantTest data from https://doi.org/10.1039/C8SC04228D
HRID 991234 reaction equation
HRID 991234As reactantuspto-grants-2002_10
HRID 991235 reaction equation
HRID 991235As reactantuspto-grants-2002_10
HRID 1115605 reaction equation
HRID 1115605As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1358437 reaction equation
HRID 1358437As reactantuspto-grants-2003_07
HRID 1358438 reaction equation
HRID 1358438As reactantuspto-grants-2003_07

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes