Basic information
- CAS
46054-87-9- Standard SMILES
CC(C)NCc1ccccc1Cl- InChIKey
AHXJNCOFVXXIAS-UHFFFAOYSA-N- Molecular formula
- C10H14ClN
- Average molar mass
- 183.68 g/mol
- Monoisotopic mass
- 183.08147713
Names & identifiers
- Preferred name
- N-[(2-Chlorophenyl)methyl]propan-2-amine
- IUPAC
- N-[(2-chlorophenyl)methyl]propan-2-amine
- English name
- CHEMBRDG-BB 4024825
- Molecular formula
- C10H14ClN
- Molecular weight
- 183.68
Names & synonyms
46054-87-9(2-CHLOROBENZYL)ISOPROPYLAMINEN-(2-chlorobenzyl)propan-2-amineN-[(2-Chlorophenyl)methyl]propan-2-amine[(2-chlorophenyl)methyl](propan-2-yl)amineN-(2-Chlorophenylmethyl)isopropylamineMFCD08691701SCHEMBL2471237DTXSID10589311AHXJNCOFVXXIAS-UHFFFAOYSA-N(2-chloro-benzyl)-isopropyl-amineN-(2-chlorobenzyl)-N-isopropylamine
Show more names
CHEMBRDG-BB 4024825UKRORGSYN-BB BBV-042345(2-chlorobenzyl)isopropylamine(SALTDATA: HCl)Benzenemethanamine, 2-chloro-N-(1-methylethyl)-
STK511998AKOS000151909AS-93720EN300-32128C78237AN-329/43385251
Database identifiers
- CAS
46054-87-9- PubChem CID
- 17138392
- DTXSID
DTXSID10589311
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 125
Physicochemical properties
- Boiling point
- 70 °C · 70 °C(Press: 0.9 Torr)
- Density
- 1.041 · 1.041±0.06 g/cm3(Predicted)
- pka
- 9.03 · 9.03±0.19(Predicted)
Chemistry & industry
Applications
UsesN-(2-Chlorobenzyl)isopropylamine serves as a reagent in the preparation of new amebicides and also in the preparation of some N-alkyl-N-benzylhaloacetamides. Amecides drugs are used to eradicate the parasitic specie of amebae in animals or humans.
Suppliers9 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
郑州康弗辰医药科技有限公司18210788515; 18210788515 · [email protected]
哈辉（上海）医药技术有限公司021-13472633-721 13472633721
ANHUI WITOP BIOTECH CO., LTD+8618071025641 · [email protected]
ANHUI BYERSEN BIOTECH CO. LTD+86-15385096007 +86-17755058861 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
唐山金元生物技术有限公司15222523250 · [email protected]
Related reactions
2 records
Compound notes
Loading…