![Chemical structure of 2-[(4-TERT-BUTYL-2,6-DIMETHYLPHENYL)METHYL]-4,5-DIHYDRO-1H-IMIDAZOLE, CAS 526-36-3](https://api.angenesci.com/structure/2075/526-36-3.png)
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| CAS Number | 526-36-3 |
| Catalog Number | AG019H31(AGN-PC-0SD81X) |
| Chemical Name | 2-[(4-TERT-BUTYL-2,6-DIMETHYLPHENYL)METHYL]-4,5-DIHYDRO-1H-IMIDAZOLE |
| EC Number | 208-390-6 |
| IUPAC Name | 2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole |
| InChI | InChI=1S/C16H24N2/c1-11-8-13(16(3,4)5)9-12(2)14(11)10-15-17-6-7-18-15/h8-9H,6-7,10H2,1-5H3,(H,17,18) |
| InChI Key | HUCJFAOMUPXHDK-UHFFFAOYSA-N |
| MDL Number | MFCD00242956 |
| Molecular Formula | C16H24N2 |
| Molecular Weight | 244.3752 |
| SMILES | Cc1cc(cc(c1CC2=NCCN2)C)C(C)(C)C |
| UNII | WPY40FTH8K |
| Synonyms | 2-(4'-tert-butyl-2',6'-dimethylphenylmethyl)imidazoline,
Amidrin,
Balkis,
Chlorohist-LA,
Decongest,
espa-rhin,
Gelonasal,
Idasal,
Idril N,
Imidin,
Nasan,
Nasengel AL,
NasenGel ratiopharm,
Nasenspray AL,
NasenSpray ratiopharm,
Nasentropfen AL,
NasenTropfen ratiopharm,
Novorin,
Otradrops,
Otraspray,
Otriven,
Otrivin,
Otrivin Mentol,
Rapako,
schnupfen endrine,
Snup,
stas,
xylometazoline,
xylometazoline hydrochloride,
xylometazoline monohydrochloride,
xylometazoline,
Xylomethazoline,
Otrivine,
526-36-3,
Otriven,
Otrivin,
Otrix,
UNII-WPY40FTH8K,
Xylometazoline [INN:BAN],
Ba-11391,
Xylometazolinum [INN-Latin],
Xilometazolina [INN-Spanish],
2-(4-tert-Butyl-2,6-dimethyl-benzyl)-4,5-dihydro-1H-imidazole,
EINECS 208-390-6,
Ba 11391,
WPY40FTH8K,
2-(4-tert-Butyl-2,6-dimethylbenzyl)-2-imidazoline,
BRN 0180524,
CHEMBL312448,
2-IMIDAZOLINE, 2-(4-tert-BUTYL-2,6-DIMETHYLBENZYL)-,
CHEBI:10082,
HUCJFAOMUPXHDK-UHFFFAOYSA-N,
2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole,
2-(4-tert-Butyl-2,6-dimethylbenzyl)-4,5-dihydro-1H-imidazole,
EN300-02385,
1H-Imidazole, 2-[[4-(1,1-dimethylethyl)-2,6-dimethylphenyl]methyl]-4,5-dihydro-,
stas,
Xylometazolinum,
Xilometazolina,
2-{[4-(tert-butyl)-2,6-dimethylphenyl]methyl}-2-imidazoline,
Novorin,
2-(4-(tert-butyl)-2,6-dimethylbenzyl)-4,5-dihydro-1H-imidazole,
1H-Imidazole, 2-((4-(1,1-dimethylethyl)-2,6-dimethylphenyl)methyl)-4,5-dihydro-,
NCGC00016101-02,
CAS-1218-35-5,
Balminil (TN),
Xylometazoline (INN),
Spectrum_000382,
2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride,
AC1L1KYN,
AC1Q2GWN,
Prestwick0_000223,
Prestwick1_000223,
Prestwick2_000223,
Prestwick3_000223,
Spectrum2_000945,
Spectrum3_000586,
Spectrum4_000382,
Spectrum5_001469,
Lopac-X-6000,
Lopac0_001269,
SCHEMBL34087,
BSPBio_000265,
BSPBio_002032,
GTPL517,
KBioGR_000903,
KBioSS_000862,
5-23-07-00109 (Beilstein Handbook Reference),
DivK1c_000158,
SPBio_000910,
SPBio_002186,
BPBio1_000293,
DTXSID8046957,
BDBM30703,
cid_5282386,
CTK4J6214,
KBio1_000158,
KBio2_000862,
KBio2_003430,
KBio2_005998,
KBio3_001532,
ZINC57534,
2-(4'-tert-butyl-2',6'-dimethylphenylmethyl)imidazoline,
NINDS_000158,
HMS3604M22,
ZX-AL000401,
SBB038185,
STK558658,
AKOS000115430,
CCG-205342,
DB06694,
KS-5071,
MCULE-9501725536,
2-[[4-(1,1-Dimethylethyl)-2,6-dimethylphenyl]methyl]-4,5-dihydro-1H-imidazole,
IDI1_000158,
SEL14934364,
NCGC00016101-01,
NCGC00016101-03,
NCGC00016101-04,
NCGC00016101-05,
NCGC00016101-06,
NCGC00016101-07,
NCGC00016101-09,
NCGC00024281-03,
AN-45560,
CC-05925,
LS-79581,
ST024781,
SBI-0051235.P003,
DB-052151,
FT-0603452,
VU0239751-6,
C07913,
D08684,
AB00053567_11,
AB00053567_12,
526B363,
C-14837,
L001171,
BRD-K08356259-003-05-6,
BRD-K08356259-003-15-5,
F1371-0282,
2-(4-tert-butyl-2,6-dimethyl-benzyl)-2-imidazoline;hydrochloride,
2-(4-tert-Butyl-2,6-dimethylbenzyl)-4,5-dihydro-1H-imidazole #,
2-[(4-t-butyl-2,6-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole,
2-[(4-t-butyl-2,6-dimethylphenyl)methyl]4,5dihydro-1H-imidazole,
2-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-4,5-dihydro-1H-imidazole,
1H-Imidazole, 2-((4-(1,1-dimethylethyl)-2,6-dimethylphenyl)methyl)-4,5-dihydro- (9CI),
1H-Imidazole,2-[[4-(1,1-dimethylethyl)-2,6-dimethylphenyl]methyl]-4,5-dihydro-,
2-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride,
rhinoxilin,
Decongest,
Gelonasal,
Otradrops,
Otraspray,
Amidrin,
Balkis,
Idasal,
Imidin,
Rapako,
Nasan,
Snup,
espa-rhin,
Otrivin Mentol,
Nasentropfen AL,
Chlorohist-LA,
Nasenspray AL,
schnupfen endrine,
Nasengel AL,
Idril N,
Xylometazoline hydrochloride,
Xylometazoline HCl,
NasenGel ratiopharm,
NasenSpray ratiopharm,
NasenTropfen ratiopharm,
D0Y4DY,
MLS000069695,
xylometazoline monohydrochloride,
CID5709,
C16H24N2,
C16-H24-N2,
SMR000058526,
C009695,
Xylometazoline (nasal mucoadhesive/MucoAd, congestion),
Decongestant (nasal mucoadhesive/MucoAd, congestion), Strategic BioSciences,
Xylometazoline (nasal mucoadhesive/MucoAd, congestion), Strategic BioSciences,
1218-35-5,
|
| Complexity | 302 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.194g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.382g/mol |
| Monoisotopic Mass | 244.194g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 24.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
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