Basic information
- CAS
51226-14-3- Standard SMILES
CC1(c2cccc(N)c2)OCCO1- InChIKey
ZXMQVZUQYHIOKO-UHFFFAOYSA-N- Molecular formula
- C10H13NO2
- Average molar mass
- 179.22 g/mol
- Monoisotopic mass
- 179.09462866
Names & identifiers
- Preferred name
- 3-(2-Methyl-1,3-dioxolan-2-yl)aniline
- IUPAC
- 3-(2-methyl-1,3-dioxolan-2-yl)aniline
- English name
- 3-(2-Methyl-1,3-dioxolan-2-yl)aniline
- Molecular formula
- C10H13NO2
- Molecular weight
- 179.22
Names & synonyms
3-(2-methyl-1,3-dioxolan-2-yl)aniline51226-14-3MFCD00020904MLS003106499Benzenamine,3-(2-methyl-1,3-dioxolan-2-yl)-3-(2-methyl-1,3-dioxolan-2-yl)phenylamineNSC159111SCHEMBL3212086SCHEMBL29841314DTXSID50303573ZXMQVZUQYHIOKO-UHFFFAOYSA-NBCA22614
Show more names
3-(2-methyl-1,3-dioxolan-2-yl)benzenamine
SBB046404STL414745AKOS005071450NSC-159111DA-25339SMR001821401CS-0215295ST45136328
Database identifiers
- CAS
51226-14-3- PubChem CID
- 292913
- DTXSID
DTXSID50303573- Nikkaji
- J1.196.248C
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 44.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 178
Physicochemical properties
- Melting point
- 72 · 72-74°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
- HS Code
- 2932990090 · 2932990090
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
- hs_code
- 2932990090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers4 total
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
1 records
Compound notes
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