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Chemical Product CAS:1324-55-6Benzo[rst]phenanthro[10,1,2-cde]pentaphene-9,18-dione,dichloro-

CAS:1324-55-6
Benzo[rst]phenanthro[10,1,2-cde]pentaphene-9,18-dione,dichloro-

  • CAS No:

    1324-55-6
  • Name:

    Benzo[rst]phenanthro[10,1,2-cde]pentaphene-9,18-dione,dichloro-
  • Molecular Formula:

    C34H14Cl2O2
  • Molecular Weight:

    525.38
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Benzo[rst]phenanthro[10,1,2-cde]pentaphene-9, ( CASNO:1324-55-6 )

Identification and Related Records
Name:
Benzo[rst]phenanthro[10,1,2-cde]pentaphene-9,18-dione,dichloro-
CAS Registry number:
1324-55-6
Synonyms:
Calcoloid Violet 4RD
Calcoloid Violet 4RP
Caledon Brilliant Purple4R
Caledon Brilliant Purple 4RP
CarbanthreneBrilliant Violet 4R
Carbanthrene Violet 2R
Carbanthrene Violet 2RP
Cibanone Violet F 2RB
Fenanthren Brilliant Violet 2R
Fenanthren BrilliantViolet 4R
Indanthren Brilliant Violet 4R
Indanthren Printing Violet F 4R
Indanthrene Brilliant Violet 4R
Indofast Violet Lake
NihonthreneBrilliant Violet 4R
Ponolith Fast Violet 4RN
SandothreneViolet 4R
Sandothrene Violet N 2RB
Symuler Fast Violet R
Tinon Violet 2RB
Tinon Violet B 4RP
Vat Bright Violet K
Vat Bright Violet KD
VatBrilliant Violet K
Vat Brilliant Violet KD
Vat Brilliant Violet KP
Vat Violet 1
C.I. VatViolet 1 (7CI,8CI)
Ahcovat Brilliant Violet 2R
Ahcovat Brilliant Violet 4R
Amanthrene Brilliant Violet RR
Atic Vat Brilliant Purple 4R
Benzadone Brilliant Purple 4R
C.I. 60010
C.I. PigmentViolet 31
EINECS(EC#):
215-380-5
Molecular Formula:
C34H14Cl2O2
Molecular Weight:
525.38
Inchi:
InChI=1/C34H14Cl2O2/c35-25-13-23-18-10-12-22-32-28(18)24(14-26(36)30(32)16-6-2-4-8-20(16)34(22)38)17-9-11-21-31(27(17)23)29(25)15-5-1-3-7-19(15)33(21)37/h1-14H
Canonical SMILES:
C1=CC=C2C(=C1)C3=C(C=C4C5=C6C(=CC(=C7C6=C(C=C5)C(=O)C8=CC=CC=C87)Cl)C9=C4C3=C(C2=O)C=C9)Cl
Chemical and Physical Properties
Density:
1.588 g/cm3
Boiling Point:
°Cat760mmHg
Refractive Index:
1.912
Flash Point:
°C
Computed Properties:
Molecular Weight:525.37976 [g/mol]
Molecular Formula:C34H14Cl2O2
XLogP3-AA:9.3
H-Bond Donor:0
H-Bond Acceptor:2
Rotatable Bond Count:0
Exact Mass:524.037085
MonoIsotopic Mass:524.037085
Topological Polar Surface Area:34.1
Heavy Atom Count:38
Formal Charge:0
Complexity:946
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:2
Feature 3D Ring Count:9
Effective Rotor Count:0
Conformer Sampling RMSD:0.6
CID Conformer Count:1
Safety and Handling
Safety:
Mildly toxic by ingestion. When heated to decomposition it emits toxic vapors of Cl.
Report:
Reported in EPA TSCA Inventory.
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