Basic information
- CAS
15029-32-0- Standard SMILES
N#CC(C=O)N1CCOCC1- InChIKey
XYMTVJUZZWUIBP-UHFFFAOYSA-N- Molecular formula
- C7H10N2O2
- Average molar mass
- 154.17 g/mol
- Monoisotopic mass
- 154.07422757
Names & identifiers
- Preferred name
- I2-Oxo-4-morpholinepropanenitrile
- IUPAC
- 2-morpholin-4-yl-3-oxopropanenitrile
- English name
- N-Cyanoacetylmorpholine
- Molecular formula
- C7H10N2O2
- Molecular weight
- 154.17
Names & synonyms
SRZ57YY35YNSC-22791RefChem:1087130I2-Oxo-4-morpholinepropanenitrile4-Morpholinepropanenitrile, beta-oxo-EINECS 239-112-1BRN 0135525SCHEMBL7220778beta-Oxo-4-morpholinepropanenitrileAKOS B028857AKOS BBS-00006373BUTTPARK 33\06-07
Show more names
CyanoacetmorpholideWLN: T6N DOTJ AV1CNRARECHEM BG FB 0100N-Cyanoacetylmorpholinecyanoaceticacidmorpholide4-(cyanoacetyl)-morpholin1-(cyanoacetyl)morpholine
Database identifiers
- CAS
15029-32-0- PubChem CID
- 27003
- UNII
- SRZ57YY35Y
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 53.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 178
Physicochemical properties
- Melting point
- 87 °C · 87 °C
- Boiling point
- 277.52 °C · 277.52°C (rough estimate)
- Density
- 1.2293 · 1.2293 (rough estimate)
- refractive index
- 1.488 · 1.4880 (estimate)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- pka
- 5.48 · 5.48±0.20(Predicted)
- form
- powder
- color
- Pale brown
- BRN
- 135525 · 135525
- CAS DataBase Reference
- 15029 · 15029-32-0(CAS DataBase Reference)
- EPA Substance Registry System
- 4 · Morpholine, 4-(cyanoacetyl)- (15029-32-0)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
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
- tsca
- TSCA listed
- rtecs
- AM1230000
- ridadr
- 3439
- hs_code
- 2934999090
- risk_code
- 20/21/22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 36/37
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers37 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Syntechem Co.,Ltd[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
广东谦进化学试剂有限公司0751-2818792 13435114148 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…