| CAS Number | 86386-72-3 |
| Catalog Number | AG008GGL(AGN-PC-0OKBLO) |
| Chemical Name | N-Allyl-3-phenylprop-2-en-1-amine |
| IUPAC Name | 3-phenyl-N-prop-2-enylprop-2-en-1-amine |
| InChI | InChI=1S/C12H15N/c1-2-10-13-11-6-9-12-7-4-3-5-8-12/h2-9,13H,1,10-11H2 |
| InChI Key | MPYILWXWVRMLOH-UHFFFAOYSA-N |
| MDL Number | MFCD07406259 |
| Molecular Formula | C12H15N |
| Molecular Weight | 173.2542 |
| SMILES | C(/C1C=CC=CC=1)=CCNCC=C |
| Synonyms | N-(3-phenylallyl)-allylamine,
N-ALLYL-3-PHENYL-2-PROPEN-1-AMINE,
N-Allyl-3-phenylprop-2-en-1-amine,
86386-72-3,
N-Cinnamyl-N-allylamine,
AC1NG34R,
CTK5F6536,
KS-00001LMW,
DTXSID10405921,
MPYILWXWVRMLOH-UHFFFAOYSA-N,
AKOS017279315,
3-phenyl-N-prop-2-enylprop-2-en-1-amine,
[(2E)-3-phenylprop-2-en-1-yl](prop-2-en-1-yl)amine,
N-cinnamylprop-2-en-1-amine,
CID4717907,
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| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 173.12g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 173.259g/mol |
| Monoisotopic Mass | 173.12g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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