| CAS Number | 1113041-80-7 |
| Catalog Number | AG007T64(AGN-PC-0WAJ5C) |
| Chemical Name | (S)-1-(2-nitrophenyl)ethanamine (Hydrochloride) |
| IUPAC Name | (1S)-1-(2-nitrophenyl)ethanamine;hydrochloride |
| InChI | InChI=1S/C8H10N2O2.ClH/c1-6(9)7-4-2-3-5-8(7)10(11)12;/h2-6H,9H2,1H3;1H/t6-;/m0./s1 |
| InChI Key | HFXVLGOYQIKRTO-RGMNGODLSA-N |
| MDL Number | MFCD18206942 |
| Molecular Formula | C8H11ClN2O2 |
| Molecular Weight | 202.6381 |
| SMILES | Cl.C[C@H](N)C1=C(C=CC=C1)[N+]([O-])=O |
| Synonyms | (S)-1-(2-Nitrophenyl)ethanamine hydrochloride,
1113041-80-7,
(S)-1-(2-NITROPHENYL)ETHANAMINE HCL,
(S)-1-(2-nitrophenyl)ethanaMine (Hydrochloride),
CTK8C4320,
DTXSID40649391,
CS-M0089,
KS-00001DZ7,
ANW-71561,
MFCD18206942,
AKOS016007354,
AK-78356,
CS-14170,
AX8224641,
TC-160306,
(S)-1-(2-nitrophenyl)ethanamine(Hydrochloride),
(1S)-1-(2-Nitrophenyl)ethan-1-amine--hydrogen chloride (1/1),
(S)-1-(2-nitrophenyl)ethan-1-amine hydrochloride,
|
| Complexity | 167 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 202.638g/mol |
| Monoisotopic Mass | 202.051g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 71.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P280-P301+P312-P302+P352-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number