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Lisadimate

CAT: 0931-T32789Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T32789Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
136-44-7
Target
Others
Related Pathways
Others
Bioactivity
Lisadimate is a sunscreening agent.
Smiles
O=C(OCC(O)CO)C1=CC=C(N)C=C1
Molecular Formula
C10H13NO4
Molecular Weight
211.21
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2,3-Dihydroxypropyl 4-aminobenzoate

used as sunscreening agent

CAS Number136-44-7
PubChem CID8692
IUPAC Name2,3-dihydroxypropyl 4-aminobenzoate
Molecular FormulaC10H13NO4
Molecular Weight211.21
XLogP0.2
Topological Polar Surface Area92.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count15
Formal Charge0
Complexity202
SMILES
C1=CC(=CC=C1C(=O)OCC(CO)O)N
InChI
InChI=1S/C10H13NO4/c11-8-3-1-7(2-4-8)10(14)15-6-9(13)5-12/h1-4,9,12-13H,5-6,11H2
InChIKey
WHQOKFZWSDOTQP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,3-Dihydroxypropyl 4-aminobenzoate
CAS: 136-44-7
CID: 8692
Formula: C10H13NO4
MW: 211.21
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight211.21
XLogP30.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass211.08445790
Monoisotopic Mass211.08445790
Topological Polar Surface Area92.8 Ų
Heavy Atom Count15
Formal Charge0
Complexity202
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes