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Home > Encyclopedia > Benzoic acid, 4-[1-[(2,4-diamino-6-pteridinyl)methyl]-3-butyn-1-yl]-

Benzoic acid, 4-[1-[(2,4-diamino-6-pteridinyl)methyl]-3-butyn-1-yl]-

Benzoic acid, 4-[1-[(2,4-diamino-6-pteridinyl)methyl]-3-butyn-1-yl]- structure

Benzoic acid, 4-[1-[(2,4-diamino-6-pteridinyl)methyl]-3-butyn-1-yl]- 

structure
  • CAS No:

    146464-93-9

  • Formula:

    C18H16N6O2

  • Chemical Name:

    Benzoic acid, 4-[1-[(2,4-diamino-6-pteridinyl)methyl]-3-butyn-1-yl]-

  • Synonyms:

    Benzoic acid, 4-[1-[(2,4-diamino-6-pteridinyl)methyl]-3-butyn-1-yl]-;10-Propargyl-4-deoxy-4-amino-10-deazapteroic acid;4-[1-[(2,4-Diamino-6-pteridinyl)methyl]-3-butynyl]benzoic acid;4-(1-(2,4-diaMinopteridin-6-yl)pent-4-yn-2-yl)benzoic acid;Benzoic acid, 4-[1-[(2,4-diaMino-6-pteridinyl)Methyl]-3-butynyl]-

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Benzoic acid, 4-[1-[(2,4-diamino-6-pteridinyl)methyl]-3-butyn-1-yl]- Basic Attributes

348.35864

348.133

DTXSID30451485

Characteristics

141

1.3

1.444

642.1±65.0 °C(Predicted)

Safety Information

P201, P202, P264, P270, P281, P301+P310, P308+P313, P321, P330, P405, P501

H301

Computed Properties

Molecular Weight:348.4
XLogP3:1.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:348.13347377
Monoisotopic Mass:348.13347377
Topological Polar Surface Area:141
Heavy Atom Count:26
Complexity:541
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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