Basic information
- CAS
3085-36-7- Standard SMILES
CC(C)COCO- InChIKey
QONBKISCDWCHKF-UHFFFAOYSA-N- Molecular formula
- C5H12O2
- Average molar mass
- 104.15 g/mol
- Monoisotopic mass
- 104.08372962
Names & identifiers
- Preferred name
- Isobutoxymethanol
- IUPAC
- 2-methylpropoxymethanol
- English name
- isobutoxymethanol
- Molecular formula
- C5H12O2
- Molecular weight
- 104.15
Names & synonyms
Isobutoxymethanol3085-36-7Methanol, (2-methylpropoxy)-Methanol, 1-(2-methylpropoxy)-EINECS 221-396-3DTXSID1062839RefChem:791585DTXCID3038270221-396-3(2-METHYLPROPOXY)METHANOLSCHEMBL1160767SCHEMBL1160768
Show more names
2-Methylpropyloxymethanol
SCHEMBL11343494QONBKISCDWCHKF-UHFFFAOYSA-NSY373024NS00045663
Database identifiers
- CAS
3085-36-7- PubChem CID
- 76517
- DTXSID
DTXSID1062839- EC Number
- 221-396-3
- Nikkaji
- J217.249F
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 35.1
Physicochemical properties
- EPA Substance Registry System
- Methanol, (2-methylpropoxy)- (3085-36-7)
- RIDADR
- 1993 · 1993
- TSCA
- TSCA listed
- HazardClass
- 3.2 · 3.2
- PackingGroup
- III
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Safety data
- tsca
- TSCA listed
- ridadr
- 1993
- hazard_class
- 3.2
- packing_group
- III
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationMethanol, 1-(2-methylpropoxy)-: ACTIVE
Suppliers3 total
陕西缔都医药化工有限公司+86-029-81138252 +86-173 9270 1263 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…