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Home > Encyclopedia > 1-BENZOTHIOPHENE-3-CARBOXYLIC ACID, 2-[(3-CHLORO-1-OXOPROPYL)AMINO]-4,5,6,7-TETRAHYDRO-, ETHYL ESTER

1-BENZOTHIOPHENE-3-CARBOXYLIC ACID, 2-[(3-CHLORO-1-OXOPROPYL)AMINO]-4,5,6,7-TETRAHYDRO-, ETHYL ESTER

1-BENZOTHIOPHENE-3-CARBOXYLIC ACID, 2-[(3-CHLORO-1-OXOPROPYL)AMINO]-4,5,6,7-TETRAHYDRO-, ETHYL ESTER structure

1-BENZOTHIOPHENE-3-CARBOXYLIC ACID, 2-[(3-CHLORO-1-OXOPROPYL)AMINO]-4,5,6,7-TETRAHYDRO-, ETHYL ESTER 

structure
  • CAS No:

    60442-45-7

  • Formula:

    C14H18ClNO3S

  • Chemical Name:

    1-BENZOTHIOPHENE-3-CARBOXYLIC ACID, 2-[(3-CHLORO-1-OXOPROPYL)AMINO]-4,5,6,7-TETRAHYDRO-, ETHYL ESTER

  • Synonyms:

    AKOS BBS-00000748;1-BENZOTHIOPHENE-3-CARBOXYLIC ACID, 2-[(3-CHLORO-1-OXOPROPYL)AMINO]-4,5,6,7-TETRAHYDRO-, ETHYL ESTER;ETHYL 2-[(3-CHLOROPROPANOYL)AMINO]-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE;2-(3-chloropropanoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester;2-[(3-chloro-1-oxopropyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester;ethyl 2-(3-chloropropanoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate;ethyl 2-(3-chloropropanamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate

1-BENZOTHIOPHENE-3-CARBOXYLIC ACID, 2-[(3-CHLORO-1-OXOPROPYL)AMINO]-4,5,6,7-TETRAHYDRO-, ETHYL ESTER Basic Attributes

315.82

315.07

2934999090

Characteristics

83.6

3.6

1.309g/cm3

534.8ºC at 760 mmHg

277.2ºC

1.591

Computed Properties

Molecular Weight:315.8
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:315.0695923
Monoisotopic Mass:315.0695923
Topological Polar Surface Area:83.6
Heavy Atom Count:20
Complexity:366
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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