Basic information
- Standard SMILES
CC(N)C1(C)COC1.O=C(O)C(=O)O- InChIKey
RUDPXRVAMLSYHK-UHFFFAOYSA-N- Molecular formula
- C8H15NO5
- Average molar mass
- 205.21 g/mol
Names & identifiers
- Preferred name
- 1-(3-Methyloxetan-3-yl)ethan-1-amineoxalate
- IUPAC
- 1-(3-methyloxetan-3-yl)ethanamine;oxalic acid
- English name
- oxalic acid
- Molecular formula
- C8H15NO5
- Molecular weight
- 205.21
Names & synonyms
CS-01728251-(3-Methyloxetan-3-yl)ethan-1-amineoxalatehemi(oxalic acid) - [M84755]1-(3-methyloxetan-3-yl)ethanamine1-(3-methyloxetan-3-yl)ethan-1-amine hemioxalate
Database identifiers
- CAS
2102409-45-8
Properties
Computed structural properties
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 160
Physicochemical properties
- storage temp.
- 0 · Store at 0-8 °C
- Appearance
- white solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 303 · H303-H320
- Precautionary statements
- 312 · P312-P264-P305+P351+P338-P337+P313
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H303-H320
- Precautionary statements
- P312-P264-P305+P351+P338-P337+P313
Chemistry & industry
Suppliers5 total
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Aladdin Scientific[email protected]
学研惠（武汉）科技有限公司15727060112 · [email protected]
金瓯生物医药（南京）有限公司13000000000 · [email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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