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| CAS Number | 2627-86-3 |
| Catalog Number | AG0032FS(AGN-PC-0R2797) |
| Chemical Name | (S)-(-)-1-Phenylethylamine |
| EC Number | 220-098-0 |
| IUPAC Name | (1S)-1-phenylethanamine |
| InChI | InChI=1S/C8H11N/c1-7(9)8-5-3-2-4-6-8/h2-7H,9H2,1H3/t7-/m0/s1 |
| InChI Key | RQEUFEKYXDPUSK-ZETCQYMHSA-N |
| MDL Number | MFCD00064406 |
| Molecular Formula | C8H11N |
| Molecular Weight | 121.1796 |
| SMILES | C1(=CC=CC=C1)[C@H](C)N |
| UNII | 05780F90V3 |
| Synonyms | 2627-86-3,
(S)-(-)-1-Phenylethylamine,
(S)-1-phenylethanamine,
(1S)-1-phenylethanamine,
(S)-(-)-alpha-Methylbenzylamine,
(S)-1-Phenylethylamine,
L(-)-alpha-Methylbenzylamine,
L-alpha-Methylbenzylamine,
L-1-Phenylethylamine,
(S)-alpha-Methylbenzenemethanamine,
(s)-(-)-1-methylbenzylamine,
(-)-alpha-Phenethylamine,
L-(-)-1-Phenylethylamine,
L-(-)-alpha-Phenylethylamine,
(1S)-1-phenylethan-1-amine,
S-Alfa-Methylbenzylamine,
MFCD00064406,
s-(-)-alpha-phenylethylamine,
(alphaS)-alpha-methylbenzenemethanamine,
L-(-)-alpha-methylbenzylamine,
CHEMBL282700,
UNII-05780F90V3,
(1S)-(-)-1-Phenylethylamine,
CHEBI:35321,
(S)-alpha-Methylbenzylamine,
05780F90V3,
L(-)-alpha-Methylbenzylamine, 99+%, (99% ee),
(S)-(-)-a-methyl-benzylamine,
1-Phenethylamine, (-)-,
(S)-(-)-1-Phenylethylamine, 99+%, produced by BASF AG,
EINECS 220-098-0,
PubChem6061,
(S)-1phenylethylamine,
1(S)-phenylethylamine,
L-alpha-Phenylethylamine,
(S) -1phenylethylamine,
(S)-1 phenylethylamine,
1-(S)-phenylethylamine,
(-)-|A-phenethylamine,
(S)1-Phenyl-Ethylamine,
AC1Q4UAO,
(S)-|A-phenylethylamine,
(s)-1-phenylethyl amine,
1(s)-phenyl ethyl amine,
(1S)-1-phenylethylamine,
(S)-1-phenyl-ethylamine,
(S)-1-phenylethyl-amine,
Benzenemethanamine, alpha-methyl-, (alphaS)-,
EC 220-098-0,
S(-)-|A-phenylethylamine,
(1 S)-1-phenylethanamine,
(1S)-1-phenyl-ethylamine,
(S)-1-(phenyl)ethylamine,
AC1L2PL4,
AC1Q29IQ,
AC1Q29IR,
(5)-alpha-methylbenzylamine,
SCHEMBL42904,
(S)-(-)1-phenylethylamine,
(S)-1-(phenyl)-ethylamine,
(S)-1-phenylethan-1-amine,
(S)-alpha-methyl benzylamine,
(S)-alpha-methyl-benzylamine,
(S)-PEA,
[(1S)-1-phenylethyl]amine,
KSC495O8T,
(-)-(S)-1-penylethylamine,
(S)-(-)-1-phenylethanamine,
(S)-(-)-a-methylbenzylamine,
(S)-alpha methyl benzyl amine,
SCHEMBL4166272,
Jsp005170,
(S)(-)-alpha-methylbenzylamine,
(S)-(-)-1-phenyl-ethylamine,
l(-)-alpha-methyl-benzyl amine,
(S)-(-)-|A-Methylbenzylamine,
(S)-(-)-alpha-methylbenzylamin,
(s)-(-)-alpha-phenylethylamine,
CTK3J5789,
(-)-(S)-alpha-methylbenzylamine,
(S)-(+)-alpha-methylbenzylamine,
RQEUFEKYXDPUSK-ZETCQYMHSA-N,
(S)-(-)-alpha-methyl benzylamine,
STR00933,
ZINC6030374,
(S)-(-)-alpha methyl benzyl amine,
(S)-(-)-alpha-methyl benzyl amine,
(S)-(-)-alpha-methyl-benzyl amine,
ANW-75666,
BDBM50028638,
AKOS005259686,
AKOS012313698,
AC-8774,
AN-7699,
CS-W019840,
LS30171,
MCULE-6602875097,
RTR-007733,
KS-000002Q5,
(-)-(S)-alpha-methyl-benzenemethanamine,
(S)-(-)-alpha-Methylbenzylamine, 98%,
AJ-55525,
AS-14055,
BC676690,
BR-47537,
SC-02998,
(S)(-) - 1 - PHENYLETHYLAMINE,
DB-015888,
ST2408252,
AM20060475,
FT-0601072,
FT-0605305,
P0793,
EN300-67316,
Unavailable - See ASDI_CatNo 500000747,
M-5951,
79514-EP2305695A2,
79514-EP2305696A2,
79514-EP2305697A2,
79514-EP2305698A2,
J-505090,
F0001-2350,
(S)-(-)-alpha-Methylbenzylamine, ChiPros(R), produced by BASF, >=99.0%,
(S)-(-)-alpha-Methylbenzylamine, for chiral derivatization, >=99.0%,
(S)-(-)-alpha-Methylbenzylamine, purum, >=98.0% (sum of enantiomers, GC),
98B,
1-Phenylethanamine,
1-Phenylethylamine,
(-)-1-phenylethylamine,
(S)-alpha-Phenylethylamine,
C8H11N,
(R)-(+)-1-Phenylethylamine,
(S)-(-)-?-Methylbenzylamine,
(S)-(-)-alpha-Ethylbenzylamine,
(R)-(+)-alpha-Methylbenzylamine,
(S)-1-N-Boc-2-Methylpiperazine,
KST-1A0222,
C8-H11-N,
CID75818,
AR-1A1403,
CB10415,
CB11600,
Benzenemethanamine, .alpha.-methyl-, (S)-,
Benzenemethanamine, .alpha.-methyl-, (.alpha.S)-,
(S)-(-)-1-Phenylethylamine, 99%, ee 99+% 5g,
(S)-(-)-1-Phenylethylamine, 99%, ee: 98% - 100G 100g,
3886-69-9,
6290-03-5,
169447-70-5,
3789-59-1,
|
| Complexity | 74.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 121.089g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 121.183g/mol |
| Monoisotopic Mass | 121.089g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
| Symbol: | |
| Hazard Class | 8(6.1) |
| Hazard statements | H311-H302-H314-H227 |
| Packing Group | Ⅱ |
| Precautionary statements | P501-P270-P210-P264-P280-P370+P378-P361+P364-P303+P361+P353-P301+P330+P331-P301+P312+P330-P304+P340+P310-P305+P351+P338+P310-P403+P235-P405 |
| UN Code | UN 2922 |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
| Manufacture Date: | ||
| Storage Temperature: | ||
| Formula: | ||
| Molecular Weight: | ||
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| Test: | Result: |

