Basic information
- CAS
623-59-6- Standard SMILES
CNC(=O)NC(C)=O- InChIKey
XRVHSOXXNQTWAW-UHFFFAOYSA-N- Molecular formula
- C4H8N2O2
- Average molar mass
- 116.12 g/mol
- Monoisotopic mass
- 116.0585775
Names & identifiers
- Preferred name
- Acetamide, N-[(methylamino)carbonyl]-
- IUPAC
- N-(methylcarbamoyl)acetamide
- English name
- 1-Acetyl-3-methylurea
- Molecular formula
- C4H8N2O2
- Molecular weight
- 116.12
Names & synonyms
N-Methyl-N'-acetylureaUrea, 1-acetyl-3-methyl-Acetamide, N-((methylamino)carbonyl)-Acetamide, N-[(methylamino)carbonyl]-NSC 7608BRN 1753728AI3-52260DTXSID0060773RefChem:551611DTXCID40433051-Acetyl-3-methylurea623-59-6
Show more names
Methylacetylurea1-acetyl-3-methyl-ureN-ACETYL-N'-METHYLUREA1-Acetyl-3-methylurea >
N-(methylcarbamoyl)acetamide3-acetyl-1-methylureaMFCD00026167N'-Methyl-N-acetylureaNSC7608Acetyl methyl ureaN-Acetyl-N'-methylurea #N-(methylcarbamoyl)-acetamide
Database identifiers
- CAS
623-59-6- PubChem CID
- 69337
- DTXSID
DTXSID0060773- Nikkaji
- J3.007D
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 111
Experimental & physicochemical properties
LogP-0.7
Physicochemical properties
- Melting point
- 180 °C · 180°C
- Boiling point
- 217.15 °C · 217.15°C (rough estimate)
- Density
- 1.2829 · 1.2829 (rough estimate)
- refractive index
- 1.488 · 1.4880 (estimate)
- pka
- 13.02 · 13.02±0.46(Predicted)
- form
- powder to crystal
- color
- White to Almost white
- CAS DataBase Reference
- 623 · 623-59-6(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- EPA Substance Registry System
- Acetamide, N-[(methylamino)carbonyl]- (623-59-6)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
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
- YR6850000
- hs_code
- 2925.19.9100
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 22-24/25
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationAcetamide, N-[(methylamino)carbonyl]-: INACTIVE
Suppliers34 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13318593351 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
上海耐士化工科技有限公司400-188-0725 +86 21 34310725 13611771617
天津希恩思生化科技有限公司400 638 7771 · [email protected]
江苏艾康生物医药研发有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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