Basic information
- CAS
16089-42-2- Standard SMILES
COc1cc(N)ccc1N1CCCC1- InChIKey
YVEZBGKUTDESAG-UHFFFAOYSA-N- Molecular formula
- C11H16N2O
- Average molar mass
- 192.26 g/mol
- Monoisotopic mass
- 192.12626314
Names & identifiers
- Preferred name
- Benzenamine, 3-methoxy-4-(1-pyrrolidinyl)-
- IUPAC
- 3-methoxy-4-pyrrolidin-1-ylaniline
- English name
- 1-(4-amino-2-methoxyphenyl)pyrrolidine
- Molecular formula
- C11H16N2O
- Molecular weight
- 192.26
Names & synonyms
16089-42-2Benzenamine, 3-methoxy-4-(1-pyrrolidinyl)-EINECS 240-242-6N-(4-Amino-2-methoxyphenyl)pyrrolidinePyrrolidine, 1-(4-amino-2-methoxyphenyl)-DTXSID8066006RefChem:561728DTXCID40351763-Methoxy-4-(pyrrolidin-1-yl)aniline3-methoxy-4-pyrrolidin-1-ylaniline3-methoxy-4-(1-pyrrolidinyl)anilineMFCD08753011
Show more names
3-Methoxy-4-pyrrolidinoaniline3-Methoxy-4-pyrrolidinoaniline Dihydrochloride3-methoxy-4-(1-pyrrolidinyl)aniline(SALTDATA: FREE)
1-(4-Amino-2-methoxyphenyl)pyrrolidine3-methoxy-4-(1-pyrrolidinyl)BenzenamineZNF8H2AQ7ZSCHEMBL1930522YVEZBGKUTDESAG-UHFFFAOYSA-N3-methoxy-4-pyrrolidin-1-yl-anilineAKOS000114354BS-37392
Database identifiers
- CAS
16089-42-2- PubChem CID
- 85276
- DTXSID
DTXSID8066006- UNII
- ZNF8H2AQ7Z
- EC Number
- 240-242-6
- Nikkaji
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 38.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 180
Physicochemical properties
- Boiling point
- 376.2 · 376.2±32.0 °C(Predicted)
- Density
- 1.129 · 1.129±0.06 g/cm3(Predicted)
- pka
- 8.05 · 8.05±0.40(Predicted)
- EPA Substance Registry System
- 3 · Benzenamine, 3-methoxy-4-(1-pyrrolidinyl)- (16089-42-2)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- TSCA
- TSCA listed
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzenamine, 3-methoxy-4-(1-pyrrolidinyl)-: INACTIVE
Suppliers8 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
海蔚化学86-21-51086038 · [email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
北京海特乐思克科技有限公司15210893940; 15116916250 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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