Basic information
- CAS
174636-87-4- Standard SMILES
CCC(N)c1ccc(C)cc1- InChIKey
FWTZOQCAVLMPJE-UHFFFAOYSA-N- Molecular formula
- C10H15N
- Average molar mass
- 149.23 g/mol
- Monoisotopic mass
- 149.12044948
Names & identifiers
- Preferred name
- 1-(4-Methylphenyl)propan-1-amine
- IUPAC
- 1-(4-methylphenyl)propan-1-amine
- English name
- 1-p-Tolyl-propylamine
- Molecular formula
- C10H15N
- Molecular weight
- 149.23
Names & synonyms
1-(4-methylphenyl)propan-1-amine174636-87-41-(p-Tolyl)propan-1-amine1-p-Tolyl-propylamine1-(4-Methylphenyl)-1-propanamineMFCD02244256Benzenemethanamine, alpha-ethyl-4-methyl-1-p-Tolylpropan-1-amine1-(4-methylphenyl)propylamineASINEX-REAG BAS 165786451-(p-Tolyl)-1-propanamineAKOS BC-2618
Show more names
1-(p-Tolyl)
SCHEMBL8286101DTXSID70395192AKOS B006608FWTZOQCAVLMPJE-UHFFFAOYSA-NART-CHEM-BB B006608CHEMBRDG-BB 4006321HMS1783L10ALBB-001475
Database identifiers
- CAS
174636-87-4- PubChem CID
- 3697774
- DTXSID
DTXSID70395192- Nikkaji
- J3.431.632E
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 103
Physicochemical properties
- Boiling point
- 228.3 · 228.3±9.0 °C(Predicted)
- Density
- 0.935 · 0.935±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 9.5 · 9.50±0.10(Predicted)
- Appearance
- Colorless to light yellow Liquid
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H314
- Precautionary statements
- 260 · P260-P264-P270-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P405-P501
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
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
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H302-H314
- Precautionary statements
- P260-P264-P270-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P405-P501
Chemistry & industry
Suppliers10 total
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
北京蓝博特科技有限公司010-56330744 18310155299 · [email protected]
上海策嵘生物科技有限公司（定制合成实验室）13917420128 13062833949 · [email protected]
河北博新生物科技有限公司19131160546 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
北京珐默兹医药科技有限公司010-80339217; 13331045123 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
上海锐谱医药科技有限公司15895968936 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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