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L-Serine Benzyl Ester

CAT: 1299-RM-C032512-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-C032512-01Size:10 mg
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CAS Number
60022-62-0
Synonyms
Benzyl L-serinate
Molecular Formula
C10H13NO3
Molecular Weight
195.22
Product Name Synonym
Benzyl L-serinate

Chemical Information

Benzyl L-serinate--hydrogen chloride (1/1)
CAS Number60022-62-0
PubChem CID12930233
IUPAC Namebenzyl (2S)-2-amino-3-hydroxypropanoate;hydrochloride
Molecular FormulaC10H14ClNO3
Molecular Weight231.67
Topological Polar Surface Area72.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count15
Formal Charge0
Complexity178
SMILES
C1=CC=C(C=C1)COC(=O)[C@H](CO)N.Cl
InChI
InChI=1S/C10H13NO3.ClH/c11-9(6-12)10(13)14-7-8-4-2-1-3-5-8;/h1-5,9,12H,6-7,11H2;1H/t9-;/m0./s1
InChIKey
MGZWCDQAKCHOBX-FVGYRXGTSA-N
Chemical Structure
2D Structure
2D structure of Benzyl L-serinate--hydrogen chloride (1/1)
CAS: 60022-62-0
CID: 12930233
Formula: C10H14ClNO3
MW: 231.67
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight231.67
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass231.0662210
Monoisotopic Mass231.0662210
Topological Polar Surface Area72.6 Ų
Heavy Atom Count15
Formal Charge0
Complexity178
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