Guidechem | China Chemical Manufacturers,suppliers,B2B Marketplace
Encyclop..
  • Products
  • Encyclopedia
  • Buy offers
  • Suppliers
Home> Encyclopedia >   /  Emulsifiers  /  Herbal Extract  /  Pharmaceutical Intermediates  /  Organic Intermediate  /  Other Inorganic Chemicals
PB218421880 structure
PB218421880 structure

PB218421880

Iupac Name:(1S,2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid
CAS No.:77-52-1
Molecular Weight:456.70032
1. Names and Identifiers
1.1 Name
PB218421880
1.2 Synonyms

2,2-dichloro-n-{4-[methoxy(methyl)sulfamoyl]phenyl}-1-methylcyclopropane-1-carboxamide MCULE-9289491031 MOLPORT-027-937-981 Z218344412

1.3 CAS No.
77-52-1
1.4 CID
64945
1.5 Molecular Formula
C15H17Cl2N3O2 (isomer)
1.6 Inchi
InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21+,22-,23+,24+,27+,28-,29-,30+/m1/s1
1.7 InChkey
WCGUUGGRBIKTOS-GPOJBZKASA-N
1.8 Canonical Smiles
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O
1.9 Isomers Smiles
C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]2[C@H]1C)C)C(=O)O
2. Properties
3.1 Melting point
283-285℃
3.1 Refractive index
1.4940 (estimate)
3.1 Vapour pressure
3.49X10-14 mm Hg at 25 deg C (est)
3.1 Precise Quality
456.36000
3.1 PSA
57.53000
3.1 logP
7.08950
3. Safety and Handling
4.1 Risk Statements
R36/37/38
4.1 Safety Statements
S24/25
4.1 RIDADR
OTH
4.1 WGK Germany
-
4.1 RTECS
YU9520000
4. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Not classified.

2.2 GHS label elements, including precautionary statements

Pictogram(s) No symbol.
Signal word

No signal word.

Hazard statement(s)

none

Precautionary statement(s)
Prevention

none

Response

none

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

5. Computational chemical data
  • Molecular Weight:456.70032g/mol
  • Molecular Formula:C15H17Cl2N3O2
  • Compound Is Canonicalized:True
  • XLogP3-AA:7.3
  • Exact Mass:456.36034539
  • Monoisotopic Mass:456.36034539
  • Complexity:874
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:57.5
  • Heavy Atom Count:33
  • Defined Atom Stereocenter Count:10
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
6. Question & Answer
  • What is Ursolic Acid? Feb 11 2022
    Benefits Of Ursolic Acid Build muscle Ursolic acid can increase muscle strength and reduce a laboratory marker of muscle damage. Lose weight Ursolic acid may help reduce body weight, BMI and waist circumference. Diabetes Ursolic acid can improve fasting blood glucose levels and insulin sensitivity....
7. Recommended Suppliers
Global444SuppliersView all >>
  • Products:Pharmaceutical raw materials,Chemical reagent, Food aditives,Plant ExtracPharmaceutical and pesticide intermediates.
  • Tel:86-431-81915458
  • Email:cathytan@jltely.com
Ursolic acid
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 1 USD/gram
  • Time: 2022/05/27
Inquire
  • Products:chemical industry and Pharmaceutical Intermediates products
  • Tel:0086-0311-88888888
  • Email:lisa@zhanyaobio.com
Ursolic Acid
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 200 RMB/kilogram
  • Time: 2022/05/27
Inquire
  • Products:Division I, the main production Lead acetate phenylacetamide Cyromazine quality is very good!
  • Tel:86-311-66561638
  • Email:xing@yan-xi.com
Ursolic Acid/Loquat Leaf Extract/CAS No: 77-52-1
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 200 RMB/kilogram
  • Time: 2022/05/26
Inquire
  • Products:biotechnology pharmaceutical intermediates biotechnology medical intermediates
  • Tel:0086-0310-15343106358
  • Email:guide@cnyouze.com
ursolic acid CAS:77-52-1 Brand:YOUZE
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 19 USD/kg
  • Time: 2022/05/24
Inquire
  • Products:Cosmetic Raw Materials,solvents,etc.
  • Tel:86-311-66562153
  • Email:spring@crovellbio.com
Factory hot selling Ursolic acid CAS 77-52-1 with best price
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 1 USD/gram
  • Time: 2022/05/05
Inquire