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Home> Encyclopedia > Hot Product Listed G   > Glycine,N-(phenylmethyl)-, ethyl ester
6436-90-4 structure

Glycine,N-(phenylmethyl)-, ethyl ester

Iupac Name:ethyl 2-(benzylamino)acetate
CAS No.:6436-90-4
EINECS(EC#): 229-218-6
Molecular Weight:193.246
Molecular Formula:C11H15NO2 (isomer)
Names and Identifiers
Synonyms

(benzylamino)acetic acid ethyl ester 436b904 AB0003324 AB1007811 AC1L309R AC1Q350I AC1Q350J AC1Q350K AC1Q65BM AC-25476 ACMC-1B8O5 ACT03187 ai3-06524 AJ-22312 AK-26991 AKOS000251246 AM002657 AM81797 ANW-34859 AS-11901 BC209253 benzylamino-acetic acid ethyl ester benzylaminoacetic acid, ethyl ester benzylglycine ethyl ester benzyl-glycine ethyl ester BG01510165 BR-26991 bzl-gly-oet CS-W010686 CTK3J0111 DTXSID90214578 EBD2198177 einecs 229-218-6 ethyl (benzylamino)acetate ethyl (benzylamino)acetate # ethyl 2-(benzylamino)acetate ethyl 2-[benzylamino]acetate ethyl 2-benzylaminoacetate ethyl benzylaminoacetate ethyl benzylglycinate ethyl jv-benzylglycinate ethyl n-(phenylmethyl)glycinate ethyl n-benzylglycinate ethyl n-benzyl-glycinate Ethyl N-benzylglycine ethyl-n-(benzyl)glycinate ethyl-n-benzylglycinat F0001-1742 F-9412 FT-0649263 glycine, n-(phenylmethyl)-, ethyl ester Glycine,N-benzyl-, ethyl ester (6CI,7CI,8CI) I01-0793 KB-252242 KB-57739 KS-00000JL5 KSC490C1D LS40795 M-7266 MCULE-3705208819 mfcd00009174 MOLPORT-000-881-703 n-(benzyl)glycine ethyl ester N-(Ethoxycarbonylmethyl)-N-benzylamine N-(Phenylmethyl)glycine ethyl ester n-benzyl glycine ethyl ester n-benzylglycine ethyl ester n-benzyl-glycine ethyl ester n-benzylglycine ethyl ester, 97% n-benzylglycine ethyl ester, purum, >=95.0% (gc) n-benzylglycine ethylester n-benzylglycine, ethyl ester n-benzylglycineethylester N-Benzyl-O-ethylglycinate n-bzl-gly-oet OR315902 RP25247 RTC-062018 SBB003613 SC-12695 SCHEMBL75205 ST2412908 ST50406333 STL363944 TC-062018 TL8004556 TRA-0190486 ULOLIZHBYWAICY-UHFFFAOYSA-N VZ36510 W-104846 Z266079588 ZINC404300

Inchi
InChI=1S/C11H15NO2/c1-2-14-11(13)9-12-8-10-6-4-3-5-7-10/h3-7,12H,2,8-9H2,1H3
InChkey
ULOLIZHBYWAICY-UHFFFAOYSA-N
Canonical Smiles
CCOC(=O)CNCC1=CC=CC=C1
Properties
Appearance
Clear, colorless liquid.
Density
1.031
Boiling Point
140-142℃ (10 mmHg)
Refractive Index
1.5045-1.5065
Flash Point
112℃
Solubility
Insoluble
Stability
No data.
HS Code
2922499990
Storage temp
2-8°C
Safety and Handling
Hazard Codes
C
Risk Statements
R34
Safety Statements
S26;S36/37/39;S45
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Skin corrosion, Category 1B

Serious eye damage, Category 1

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H314 Causes severe skin burns and eye damage

Precautionary statement(s)
Prevention

P260 Do not breathe dust/fume/gas/mist/vapours/spray.

P264 Wash ... thoroughly after handling.

P280 Wear protective gloves/protective clothing/eye protection/face protection.

Response

P301+P330+P331 IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.

P303+P361+P353 IF ON SKIN (or hair): Take off immediately all contaminated clothing. Rinse skin with water [or shower].

P363 Wash contaminated clothing before reuse.

P304+P340 IF INHALED: Remove person to fresh air and keep comfortable for breathing.

P310 Immediately call a POISON CENTER/doctor/\u2026

P321 Specific treatment (see ... on this label).

P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.

Storage

P405 Store locked up.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Precursor and Product
Computational chemical data
  • Molecular Weight:193.246g/mol
  • Molecular Formula:C11H15NO2
  • Compound Is Canonicalized:True
  • Exact Mass:193.11
  • Monoisotopic Mass:193.11
  • Complexity:165
  • Rotatable Bond Count:6
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:38.3A^2
  • Heavy Atom Count:14
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADccByMAAAAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAHgAQAAAADADhmAYyCILABACI AiDSCACCAAAgAAAIiICIBIgKICKAkTGHIAhggACYiAcQgAAOAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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