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| CAS Number | 62-51-1 |
| Catalog Number | AG003RHJ(AGN-PC-0JK7GZ) |
| Chemical Name | Methacholine Chloride, Crystal, USP |
| EC Number | 200-537-2 |
| IUPAC Name | 2-acetyloxypropyl(trimethyl)azanium;chloride |
| InChI | InChI=1S/C8H18NO2.ClH/c1-7(11-8(2)10)6-9(3,4)5;/h7H,6H2,1-5H3;1H/q+1;/p-1 |
| InChI Key | JHPHVAVFUYTVCL-UHFFFAOYSA-M |
| MDL Number | MFCD00011817 |
| Molecular Formula | C8H18ClNO2 |
| Molecular Weight | 195.6870 |
| NSC Number | 757090 |
| SMILES | C([N+](C)(C)C)C(OC(=O)C)C.[Cl-] |
| Synonyms | 2-(Acetyloxy)-N,N,N-trimethyl-1-propanaminium Chloride,
Acetyl 2 methylcholine Chloride,
Acetyl beta methacholine Chloride,
Acetyl beta methylcholine,
Acetyl-2-methylcholine Chloride,
Acetyl-beta-methacholine Chloride,
Acetyl-beta-methylcholine,
Chloride, Methacholine,
Mecholine,
Mecholyl,
Methacholine,
Methacholine Chloride,
Provocholine,
Provokit,
Methacholine chloride,
62-51-1,
Acetyl-beta-methylcholine chloride,
Mecholyl chloride,
Provocholine,
Amechol,
Methacholine (chloride),
Mecholine chloride,
1-Propanaminium, 2-(acetyloxy)-N,N,N-trimethyl-, chloride,
Methacholinium chloride,
Acetyl-2-methylcholine Chloride,
Acetyl-|A-methylcholine chloride,
(2-Acetoxypropyl)trimethylammonium chloride,
Metacolina cloruro [DCIT],
O-Acetyl-beta-methylcholine chloride,
beta-Methylacetylcholine chloride,
Cloruro de metacolina [Spanish],
Chlorure de methacholine [French],
Methacholini chloridum [INN-Latin],
EINECS 200-537-2,
Cloruro de metacolina [INN-Spanish],
DL-Acetyl-beta-methylcholine chloride,
Chlorure de methacholine [INN-French],
(+-)-Acetyl-beta-methylcholine chloride,
AI3-51680,
MLS000069656,
Trimethyl-beta-acetoxypropylammonium chloride,
CHEBI:50142,
(2-Hydroxypropyl)trimethylammonium chloride acetate,
Mecholyl,
Provokit,
SMR000059224,
2-acetyloxypropyl(trimethyl)azanium chloride,
2-acetyloxypropyl(trimethyl)azanium;chloride,
DSSTox_CID_3271,
A-1480,
DSSTox_RID_76951,
DSSTox_GSID_23271,
Q-200715,
2-acetyloxy-N,N,N-trimethylpropan-1-aminium chloride,
(+-)-(2-Hydroxypropyl)trimethylammonium chloride acetate,
Acetyl- beta-methylcholine chloride,
UNII-0W5ETF9M2K,
AMMONIUM, (2-HYDROXYPROPYL)TRIMETHYL-, CHLORIDE, ACETATE,
1-Propanaminium, 2-(acetyloxy)-N,N,N-trimethyl-, chloride (1:1),
1-Propanaminium, 2-(acetyloxy)-N,N,N-trimethyl-, chloride, (+-)-,
Metacolina cloruro,
Cloruro de metacolina,
Methacholini chloridum,
Chlorure de methacholine,
SR-01000000215,
0W5ETF9M2K,
Acetyl-beta-methacholine Chloride,
Methacholine chloride [INN:BAN],
Prestwick_981,
Provocholine (TN),
methacholine-chloride,
Methacholine chloride [USP:INN:BAN],
CAS-62-51-1,
Opera_ID_1285,
NCGC00016282-01,
AC1L1LU3,
REGID_for_CID_6114,
SCHEMBL69104,
C6H11ClNO2.C2H6,
MLS001148375,
SPECTRUM1500391,
2-(Acetyloxy)-N,N,N-trimethyl-1-propanaminium Chloride,
CHEMBL1200764,
DTXSID7023271,
CTK8B3014,
Acetyl-ss--methylcholine chloride,
BIA1090,
ZX-AFC001554,
HMS1570G20,
HMS1920L11,
HMS2091D06,
HMS2097G20,
HMS2232B07,
HMS3260E11,
HMS3371L18,
HMS3714G20,
Pharmakon1600-01500391,
O-Acetyl-|A-methylcholine Chloride,
HY-A0083,
Tox21_110348,
Tox21_500025,
7986AF,
ANW-41597,
CCG-39988,
Methacholine Chloride, Crystal, USP,
MFCD00011817,
NSC757090,
Acetyl b-methylcholine chloride 98%+,
AKOS015892295,
Tox21_110348_1,
API0024317,
FS-4023,
LP00025,
MCULE-3342474130,
Methacholine chloride (JAN/USAN/INN),
NSC-757090,
NCGC00015045-09,
NCGC00093548-01,
NCGC00093548-02,
NCGC00093548-03,
NCGC00093548-04,
NCGC00093548-05,
NCGC00260710-01,
AK546809,
AN-23724,
LS-18501,
2-acetoxypropyl(trimethyl)ammonium chloride,
TR-021497,
2-acetyloxypropyl(trimethyl)ammonium chloride,
AE>> OOo pound(1/4)x>>umicro (1/4)i,
EU-0100025,
FT-0628268,
M0073,
ST51039038,
A 2251,
D04970,
AE>> OOo pound-|A-(1/4)x>>umicro (1/4)i,
A833819,
C-08885,
1-methyl-2-(trimethylamino)ethyl acetate, chloride,
2-acetoxy-N,N,N-trimethylpropan-1-aminium chloride,
I02-5955,
SR-01000000215-2,
SR-01000000215-4,
SR-01000000215-7,
2-(acetyloxy)-N,N,N-trimethylpropan-1-aminium chloride,
(+/-)-(2-Hydroxypropyl)trimethylammonium chloride acetate,
methacholine,
Mecholine,
methacholinchlorid-,
Acetyl-beta-methylcholine,
Betaxolol hydrochloride,
Chloride, Methacholine,
Acetyl beta methylcholine,
C8H18NO2.Cl,
Acetyl 2 methylcholine Chloride,
C8-H18-N-O2.Cl,
Acetyl beta methacholine Chloride,
CID6114,
Methacholine chloride [BAN:INN],
CS-4292,
2-BROMO-5-(METHYLSULFONYL)PYRIDINE,
D016210,
2-(Acetyloxy)-N,N,N-trimethyl-1-propanaminium chloride (1:1),
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.687g/mol |
| Monoisotopic Mass | 195.103g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Symbol: | |
| Hazard Class | |
| Hazard statements | H302-H315-H319-H335 |
| Packing Group | |
| Precautionary statements | P261-P305+P351+P338 |
| UN Code |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
| Manufacture Date: | ||
| Storage Temperature: | ||
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