Structure

DAN

CAS
771-97-1
Catalog Number
ACM771971-2
Category
Other Fluorophores
Molecular Weight
158.2
Molecular Formula
C10H10N2

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Specification

Synonyms
2,3-Diaminophthalene
IUPAC Name
Naphthalene-2,3-diamine
Canonical SMILES
C1=CC=C2C=C(C(=CC2=C1)N)N
InChI
InChI=1S/C10H10N2/c11-9-5-7-3-1-2-4-8(7)6-10(9)12/h1-6H,11-12H2
InChI Key
XTBLDMQMUSHDEN-UHFFFAOYSA-N
Boiling Point
273.29 °C
Melting Point
197 - 203 °C
Density
1.0968 g/ml
Appearance
Off-white to light brown solid
Storage
Stored at +4 °C
Complexity
140
Covalently-Bonded Unit Count
1
EC Number
212-241-0
Emission Maximum
406 nm
Exact Mass
158.084398g/mol
Excitation Maximum
364 nm
Formal Charge
0
H-Bond Acceptor
2
H-Bond Donor
2
Heavy Atom Count
12
LogP
1.54 (LogP)
Monoisotopic Mass
158.084398g/mol
NSC Number
62692
Rotatable Bond Count
0
UNII
2BNZ6BRS87
XLogP3
1.9

Upstream Synthesis Route 1

  • 2050-75-1
  • 771-97-1

Reference: [1] Oriental Journal of Chemistry, 2017, vol. 33, # 2, p. 821 - 828

Upstream Synthesis Route 2

  • 92-44-4
  • 771-97-1

Reference: [1] Chemische Berichte, 1894, vol. 27, p. 764
[2] Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 3, p. 496
[3] Journal of the Chemical Society, 1910, vol. 97, p. 1716
[4] Oriental Journal of Chemistry, 2017, vol. 33, # 2, p. 821 - 828

Upstream Synthesis Route 3

  • 5417-63-0
  • 771-97-1

Reference: [1] Helvetica Chimica Acta, 1937, vol. 20, p. 520,524

Downstream Synthesis Route 1

  • 590-92-1
  • 771-97-1
  • 109966-81-6

Reference: [1]Chemische Berichte,1959,vol. 92,p. 2902,2912

Downstream Synthesis Route 2

  • 64-18-6
  • 771-97-1
  • 269-07-8

Reference: [1]Journal of the American Chemical Society,2013,vol. 135,p. 6411 - 6414

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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