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| CAS Number | 94-07-5 |
| Catalog Number | AG003UHA(AGN-PC-0W3PFA) |
| Chemical Name | Synephrine |
| EC Number | 202-300-9 |
| IUPAC Name | 4-[1-hydroxy-2-(methylamino)ethyl]phenol |
| InChI | InChI=1S/C9H13NO2/c1-10-6-9(12)7-2-4-8(11)5-3-7/h2-5,9-12H,6H2,1H3 |
| InChI Key | YRCWQPVGYLYSOX-UHFFFAOYSA-N |
| MDL Number | MFCD00002370 |
| Molecular Formula | C9H13NO2 |
| Molecular Weight | 167.2050 |
| SMILES | CNCC(c1ccc(cc1)O)O |
| Synonyms | Oxedrine,
Sympaethamin,
Synephrin,
Synephrine,
Synephrine,
Oxedrine,
p-Synephrine,
94-07-5,
Parasympatol,
Sympaethamine,
Sympatol,
Sympaethamin,
Analeptin,
Simpatol,
Simpalon,
Synephrin,
Synthenate,
(+/-)-Synephrine,
Sympathol,
p-Oxedrine,
4-(1-Hydroxy-2-(methylamino)ethyl)phenol,
Ethaphene,
DL-SYNEPHRINE,
Synefrin,
4-[1-Hydroxy-2-(methylamino)ethyl]phenol,
Synefrin [Czech],
Pentedrin [German],
Parakorper [German],
p-Methylaminoethanolphenol,
1-(4-Hydroxyphenyl)-N-methylethanolamine,
1-(4-Hydroxyphenyl)-2-methylaminoethanol,
Oxedrine [BAN],
NSC 166285,
p-Hydroxyphenylmethylaminoethanol,
CHEBI:29081,
S 38537-9,
EINECS 202-300-9,
beta-Methylamino-alpha-(4-hydroxyphenyl)ethyl alcohol,
Methylaminomethyl(4-hydroxyphenyl)carbinol,
1-(4-Hydroxyphenyl)-2-(methylamino)ethanol,
YRCWQPVGYLYSOX-UHFFFAOYSA-N,
(RS)-1-(4-Hydroxyphenyl)-2-(methylamino)ethanol,
Oxedrine (BAN),
p-Hydroxy-alpha-((methylamino)methyl)benzyl alcohol,
4-Hydroxy-alpha-((methylamino)methyl)benzenemethanol,
NSC166285,
Benzenemethanol, 4-hydroxy-.alpha.-[(methylamino)methyl]-,
alpha-(4-Oxyphenyl)alpha-oxy-beta-methylaminoaethan [German],
1-(4-Hydroxyphenyl)-(2-methylamino)ethanol,
BENZYL ALCOHOL, p-HYDROXY-alpha-((METHYLAMINO)METHYL)-, (-)-,
WLN: QR DYQ1M1,
DSSTox_CID_10588,
DSSTox_RID_78850,
4-Hydroxy-alpha-(methylaminomethyl)benzyl alcohol,
DSSTox_GSID_30588,
p-Hydroxy-alpha-[(methylamino)methyl]benzyl alcohol,
4-hydroxy-alpha-[(methylamino)methyl]benzenemethanol,
l-Synephrine,
Q-100668,
W-100214,
l-Sympatol,
p-((Methylamino)ethanol)phenol,
p-[(Methylamino)ethanol]phenol,
p-Hydroxy-.alpha.-[(methylamino)methyl]benzyl alcohol,
.beta.-Methylamino-.alpha.-(4-hydroxyphenyl)ethyl alcohol,
Benzyl alcohol, p-hydroxy-.alpha.-[(methylamino)methyl]-,
Parakorper,
BENZYL ALCOHOL, p-HYDROXY-alpha-((METHYLAMINO)METHYL)-,
p-Hydroxyphenyl(methylamino)ethanol,
Oxedrine ((-)-),
1-[4-Hydroxyphenyl]-2-methylaminoethanol,
582-84-3,
SMR000059111,
1-(4-Hydroxyphenyl)-(N-methylethanol)amine,
1-(4-hydroxyphenyl)-2-(methylamino)ethan-1-ol,
Oxedrine [INN:BAN],
((Methylamino)methyl)((4-hydroxyphenyl)carbinol),
[(Methylamino)methyl][(4-hydroxyphenyl)carbinol],
SR-01000002983,
p-Hydroxy-.alpha.-[(methylamino)methyl]benzylalcohol,
(+-)-N-Methyloctopamine,
Benzenemethanol, 4-hydroxy-alpha-((methylamino)methyl)-, (S)-,
MFCD00002370,
(y)-Synephrine,
Synephrine,(S),
CAS-94-07-5,
NCGC00016351-01,
(?)-Synephrine,
(+/-)synephrine,
Synephrine(Oxedrine),
(+,-)-Synephrine,
NSC 170956,
Benzenemethanol, 4-hydroxy-alpha-((methylamino)methyl)-,
Synephrine (Oxedrine),
Synephrine - Oxedrine,
Prestwick0_001088,
Prestwick1_001088,
Prestwick2_001088,
Prestwick3_001088,
(.+/-.)-Synephrine,
Lopac0_001085,
BSPBio_001136,
alpha-(4-Oxyphenyl)alpha-oxy-beta-methylaminoaethan,
MLS000069435,
MLS001424216,
CHEMBL33720,
SCHEMBL146500,
SPBio_003028,
BENZYL ALCOHOL, p-HYDROXY-alpha-((METHYLAMINO)METHYL)-, (+)-,
Synephrine, analytical standard,
(.+/-.)-N-Methyloctopamine,
AC1L1O67,
AC1Q412W,
BPBio1_001250,
DTXSID0030588,
CTK2F4574,
(+/-)-Synephrine, >=98%,
HMS1571I18,
HMS2052G09,
HMS2098I18,
HMS2233F20,
HMS3263I12,
HMS3264E11,
HMS3369C13,
HMS3394G09,
HMS3656O09,
HMS3715I18,
Pharmakon1600-01506085,
ALBB-025740,
ZX-AN024253,
Tox21_110390,
Tox21_200962,
Tox21_501085,
( inverted question mark)-Synephrine,
BBL015111,
BDBM50102660,
CS0043,
NSC170956,
NSC759316,
PDSP1_000167,
PDSP2_000166,
s2362,
SBB063601,
STK803113,
AKOS004119915,
AKOS016038542,
Tox21_110390_1,
API0024621,
CCG-101098,
CCG-205162,
DB09203,
FCH1116446,
KS-5152,
LP01085,
MCULE-4991429316,
NC00348,
NSC-166285,
NSC-170956,
NSC-759316,
RP23020,
( inverted exclamation markA)-Synephrine,
NCGC00015924-03,
NCGC00015924-04,
NCGC00015924-05,
NCGC00015924-06,
NCGC00015924-08,
NCGC00015924-09,
NCGC00015924-12,
NCGC00015924-13,
NCGC00089788-02,
NCGC00089788-03,
NCGC00089788-04,
NCGC00258515-01,
NCGC00261770-01,
(+)-[(methylamino)methyl]-Benzenemethano,
AK141733,
BP-12742,
CC-34623,
CPD000059111,
K712,
LS-43028,
LS-43029,
LS-43031,
SAM001246896,
SC-46736,
ST095769,
SBI-0051055.P002,
AB0014348,
AX8011379,
TR-038493,
AB00514040,
EU-0101085,
FT-0618685,
FT-0653012,
N1706,
S0232,
SW197214-5,
T5534,
4-[1-Hydroxy-2-(methylamino)ethyl]phenol #,
4-Hydroxy-a-(methylaminomethyl)benzyl alcohol,
94S075,
C04548,
D07148,
S 0752,
AB00384265_11,
C-33457,
I01-2279,
I01-8196,
I06-0007,
SR-01000002983-3,
SR-01000002983-7,
SR-01000002983-8,
4-Hydroxy-.alpha.-((methylamino)methyl)benzenemethanol,
7336264B-EDC9-42C5-939B-FF800AB5BB4A,
Benzenemethanol, 4-hydroxy-a-[(methylamino)methyl]-, (aR)-,
Benzenemethanol, 4-hydroxy-alpha-((methylamino)methyl)- (9CI),
Benzenemethanol, 4-hydroxy-alpha-((methylamino)methyl)-, (-)-,
Oxedrine|||4-Hydroxy-a-[(methylamino)methyl]-benzenemethanol,
Oxedrine, p-Synephrine, Sympatol, Parasympatol, Sympaethamine, 34520,
benzenemethanol, 4-hydroxy-alpha-[(methylamino)methyl]-, 2,3-dihydroxybutanedioate (1:1) (salt),
Pentedrin,
(+)-Synephrine,
(+)-p-Synephrine,
oxedrine HCl,
(-)-Synephrine,
Oxedrine tartrate,
( )-Synephrine,
D(-)-Synephrine,
Oxedrine hydrochloride,
C9H13NO2,
UNII-PEG5DP7434,
4- PHENOL,
UNII-73SNV1H5Y5,
PEG5DP7434,
UNII-9I99I5995J,
CID7172,
C9-H13-N-O2,
ACN-035676,
methylaminomethyl 4-hydroxyphenyl carbinol,
(+)-p-Hydroxy-alpha-((methylamino)methyl)benzyl alcohol,
D013578,
(-)-p-Hydroxy-alpha-((methylamino)methyl)benzyl alcohol,
614-35-7,
Benzenemethanol, 4-hydroxy-alpha-[(methylamino)methyl]-,
Synephrine, 98%, from Citrus aurantium L. - 25G 25g,
4-[1-hydroxy-2-(methylamino)ethyl]phenol 2,3-dihydroxysuccinate (salt),
532-80-9,
575-81-5,
5985-28-4,
|
| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.208g/mol |
| Monoisotopic Mass | 167.095g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 52.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.6 |
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