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| CAS Number | 3685-84-5 |
| Catalog Number | AG0034L0(AGN-PC-0RCZV1) |
| Chemical Name | 2-(dimethylamino)ethyl 2-(4-chlorophenoxy)acetate hydrochloride |
| EC Number | 222-975-3 |
| IUPAC Name | 2-(dimethylamino)ethyl 2-(4-chlorophenoxy)acetate;hydrochloride |
| InChI | InChI=1S/C12H16ClNO3.ClH/c1-14(2)7-8-16-12(15)9-17-11-5-3-10(13)4-6-11;/h3-6H,7-9H2,1-2H3;1H |
| InChI Key | FIVHOHCAXWQPGC-UHFFFAOYSA-N |
| MDL Number | MFCD00012533 |
| Molecular Formula | C12H17Cl2NO3 |
| Molecular Weight | 294.1743 |
| SMILES | Cl.ClC1=CC=C(OCC(=O)OCCN(C)C)C=C1 |
| UNII | 5BK3070BDY |
| Synonyms | Atsefen,
Centrophenoxine,
Cerutil,
Cetrexin,
Helfergin,
Meclofenoxate,
Meclofenoxate Hydrochloride,
Meclofenoxate hydrochloride,
3685-84-5,
Meclofenoxate HCl,
Centrophenoxine hydrochloride,
Lucidril,
Cerutil,
Atsefen,
Helfergin,
Marucotol,
Acefen,
Brenal,
Centrophenoxine,
Centrofenoxin,
Amipolen,
Cellative,
Proserout,
Lutiaron,
Meclophenoxate hydrochloride,
Methoxynal,
235 Anp hydrochloride,
Centrophenoxine (VAN),
2-(dimethylamino)ethyl 2-(4-chlorophenoxy)acetate hydrochloride,
Meclofenoxate (Centrophenoxine) HCl,
UNII-5BK3070BDY,
Meclofenoxate (hydrochloride),
Lucidryl hydrochloride,
Dimethylaminoethyl p-chlorophenoxyacetate hydrochloride,
NSC 4268,
EINECS 222-975-3,
2-(dimethylamino)ethyl (4-chlorophenoxy)acetate hydrochloride,
Chlorowodorki centrofenoksyna [Polish],
NSC 113619,
Dimethylaminoethyl 4-chlorophenoxyacetate hydrochloride,
5BK3070BDY,
2-(Dimethylamino)ethyl (p-chlorophenoxy)acetate hydrochloride,
p-Chlorphenoxyessigsaeure-beta-dimethylaminoaethylesters [German],
Dimethylaminoethyl ester of p-chlorophenoxyacetic acid hydrochloride,
(p-Chlorophenoxy)acetic acid 2-(dimethylamino)ethyl ester hydrochloride,
4-chlorophenoxy-acetic acid 2-(dimethylamino)ethyl ester hydrochloride,
C12H16ClNO3,
DSSTox_CID_25141,
DSSTox_RID_80699,
DSSTox_GSID_45141,
WLN: GR DO1VO2N1&1 &GH,
2-(4-Chlorophenoxy)acetic Acid 2-(Dimethylamino)ethyl Ester Hydrochloride,
ACETIC ACID, (p-CHLOROPHENOXY)-, 2-DIMETHYLAMINOETHYL ESTER, HYDROCHLORIDE,
SR-01000075788,
NCGC00015279-02,
CAS-3685-84-5,
Acetic acid, 2-(dimethylamino)ethyl ester hydrochloride,
Chlorowodorki centrofenoksyna,
Methocynal,
2-(dimethylamino)ethyl 2-(4-chlorophenoxy)acetate;hydrochloride,
(Dimethylamino)ethyl ester of (p-chlorophenoxy)acetic acid hydrochloride,
Meclofenoxate hydrochloride [JAN],
Centrophenoxine HCl,
Lucidril (TN),
Prestwick_978,
PubChem23391,
AC1Q3BLJ,
Acetic acid, (4-chlorophenoxy)-, 2-(dimethylamino)ethyl ester, hydrochloride,
C12H17Cl2NO3,
MLS002153989,
SCHEMBL218322,
SPECTRUM1503226,
AC1L2E01,
p-Chlorphenoxyessigsaeure-beta-dimethylaminoaethylesters,
CHEMBL1256131,
DTXSID8045141,
CTK8F3645,
NSC4268,
HMS1570I08,
HMS1922K09,
Pharmakon1600-01503226,
Centrophenoxine hydrochloride, 99%,
BCP21567,
Meclofenoxate hydrochloride (JP17),
NSC-4268,
Tox21_110123,
Tox21_302398,
Tox21_500250,
CCG-39961,
MFCD00012533,
NSC113619,
NSC758420,
s4280,
AKOS008968424,
Tox21_110123_1,
AC-1680,
AN-6971,
CS-2216,
KS-1179,
LP00250,
MCULE-1367655174,
NSC-113619,
NSC-758420,
NCGC00015279-08,
NCGC00093712-01,
NCGC00093712-02,
NCGC00093712-03,
NCGC00093712-04,
NCGC00180932-01,
NCGC00256151-01,
NCGC00260935-01,
BC213252,
H907,
HY-17555,
LS-11345,
SC-15165,
SMR001233323,
AB0013350,
EU-0100250,
FT-0603646,
M2460,
SW197063-3,
EN300-35717,
A14265,
C 8773,
D02243,
K-8196,
I01-1863,
SR-01000075788-1,
SR-01000075788-5,
SR-01000075788-6,
W-106584,
Dimethylaminoethyl 4-Clorophenoxyacetate Hydrochloride,
Z57281900,
2-dimethylaminoethyl 2-(4-chlorophenoxy)acetate hydrochloride,
Meclofenoxate Hydrochloride 1.0 mg/ml in Acetonitrile (as free base),
Acetic acid, (4-chlorophenoxy)-, 2-(dimethylamino)ethyl ester, hydrochloride (9CI),
meclofenoxate,
Acephen,
Cetrexin,
Meclofenoxatehydrochloride,
C12H16ClNO3.ClH,
C12-H16-Cl-N-O3.Cl-H,
CID19379,
MECLOFENOXATE HCL also CENTROPHENOXIN,
B1160,
D002504,
Acetic acid, 2-(dimethylamino)ethyl ester, hydrochloride,
Acetic acid, (p-chlorophenoxy)-, 2-(dimethylamino)ethyl ester hydrochloride,
51-68-3,
|
| Complexity | 228 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 293.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 294.172g/mol |
| Monoisotopic Mass | 293.059g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 38.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Symbol: | |
| Hazard Class | |
| Hazard statements | H302 |
| Packing Group | |
| Precautionary statements | P264-P270-P301+P312a-P330-P501a |
| UN Code |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
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