Basic information
- CAS
538342-98-2- Standard SMILES
CCCc1ccc(CN)cc1- InChIKey
XOADGIXTUMJDDN-UHFFFAOYSA-N- Molecular formula
- C10H15N
- Average molar mass
- 149.23 g/mol
- Monoisotopic mass
- 149.12044948
Names & identifiers
- Preferred name
- (4-Propylphenyl)methanamine
- IUPAC
- (4-propylphenyl)methanamine
- English name
- 4-Propylbenzylamine
- Molecular formula
- C10H15N
- Molecular weight
- 149.23
Names & synonyms
(4-Propylphenyl)methanamine538342-98-2DTXSID70478914RefChem:209016DTXCID704297244-PROPYLBENZYLAMINEMFCD03411009p-propylbenzylamine1-(4-PROPYLPHENYL)METHANAMINESCHEMBL396116AKOS013284673AS-33191
Show more names
(4-Propylphenyl)4-N-PROPYLBENZYLAMINE4-PropylbenzenemethanamineBenzenemethanamine, 4-propyl-
CS-0152415EN300-755069(4-propylphenyl)methylamineFT-0692583A855088SCHEMBL7525992SCHEMBL7525993SCHEMBL10667904
Database identifiers
- CAS
538342-98-2- PubChem CID
- 12162002
- DTXSID
DTXSID70478914- Nikkaji
- J1.916.666J
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 93
Physicochemical properties
- Boiling point
- 238.1 · 238.1±9.0 °C(Predicted)
- Density
- 0.94 · 0.940±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- pka
- 9.21 · 9.21±0.10(Predicted)
- Appearance
- Colorless to light yellow Liquid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HS Code
- 2921490090 · 2921490090
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
- 2921490090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers30 total
北京华美互利生物化工010-56205725 · [email protected]
郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
Zhejiang J&C Biological Technology Co.,Limited+1-2135480471 · [email protected]
上海珂华生物科技有限公司021-60455363 18019463053 · [email protected]
阳谷荣科商贸有限公司15863541132 · [email protected]
北京蓝博特科技有限公司010-56330744 18310155299 · [email protected]
湖州清硫硅生物科技有限公司13626726938 · [email protected]
Henan Alfa Chemical Co., Ltd+8618339805032 · [email protected]
Related reactions
2 records
Compound notes
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