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L-Cysteine methyl ester hydrochloride

CAT: 0286-C33870Size: 25 gDry Ice: NoHazardous: No
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CAT#:0286-C33870Size:25 g
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CAS Number
18598-63-5
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00038985
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Not D.O.T.-Regulated
Precautions
P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

L-Cysteine, methyl ester, hydrochloride

Mecysteine hydrochloride is an alpha-amino acid ester.

CAS Number18598-63-5
PubChem CID2733208
IUPAC Namemethyl (2R)-2-amino-3-sulfanylpropanoate;hydrochloride
Molecular FormulaC4H10ClNO2S
Molecular Weight171.65
Topological Polar Surface Area53.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count9
Formal Charge0
Complexity86
SMILES
COC(=O)[C@H](CS)N.Cl
InChI
InChI=1S/C4H9NO2S.ClH/c1-7-4(6)3(5)2-8;/h3,8H,2,5H2,1H3;1H/t3-;/m0./s1
InChIKey
WHOHXJZQBJXAKL-DFWYDOINSA-N
Chemical Structure
2D Structure
2D structure of L-Cysteine, methyl ester, hydrochloride
CAS: 18598-63-5
CID: 2733208
Formula: C4H10ClNO2S
MW: 171.65
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight171.65
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass171.0120774
Monoisotopic Mass171.0120774
Topological Polar Surface Area53.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity86.1
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes