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Thymylbutyrat

Thymylbutyrat structure

Thymylbutyrat 

structure
  • CAS No:

    78701-56-1

  • Formula:

    C11H14N2O4

  • Chemical Name:

    Thymylbutyrat

  • Synonyms:

    Buttersaeure-thymylester; 3-Butyryloxy-p-cymol; 4-butyrylamino-3-methoxy-nitrobenzene;

Thymylbutyrat Basic Attributes

238.24000

238.09535693 g/mol

157955

2924299090

Characteristics

84.15000

2.93820

1.244g/cm3

424.3ºC at 760mmHg

210.4ºC

Safety Information

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:238.24
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:238.09535693
Monoisotopic Mass:238.09535693
Topological Polar Surface Area:84.2
Heavy Atom Count:17
Complexity:277
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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