5H-Pyrrolo(3,2-d)pyrimidine-4-sulfonic acid, 7-cyano-2-phenyl-, sodium salt

Modify Date: 2025-08-25 17:57:04

5H-Pyrrolo(3,2-d)pyrimidine-4-sulfonic acid, 7-cyano-2-phenyl-, sodium salt structure	Common Name	5H-Pyrrolo(3,2-d)pyrimidine-4-sulfonic acid, 7-cyano-2-phenyl-, sodium salt
	CAS Number	84905-76-0	Molecular Weight	322.27400
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₁₃H₇N₄NaO₃S	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	sodium,7-cyano-2-phenyl-5H-pyrrolo[3,2-d]pyrimidine-4-sulfonate

Molecular Formula	C₁₃H₇N₄NaO₃S
Molecular Weight	322.27400
Exact Mass	322.01400
PSA	130.94000
LogP	2.48148

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UY9409000

CHEMICAL NAME :: 5H-Pyrrolo(3,2-d)pyrimidine-4-sulfonic acid, 7-cyano-2-phenyl-, sodium salt

CAS REGISTRY NUMBER :: 84905-76-0

LAST UPDATED :: 199103

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C13-H8-N4-O3-S.Na

MOLECULAR WEIGHT :: 323.30

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD10 - Lethal Dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >500 mg/kg

TOXIC EFFECTS :: Tumorigenic - active as anti-cancer agent

REFERENCE :: PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 16,834,1982

HS Code	2933990090

2-Phenyl-4-chloro-7-cyanopyrrolo[3.2-d]pyrimidine structure

2-Phenyl-4-chlo...

CAS#:84905-65-7

~53%

5H-Pyrrolo(3,2-d)pyrimidine-4-sulfonic acid, 7-cyano-2-phenyl-, sodium salt Structure

5H-Pyrrolo(3,2-...

CAS#:84905-76-0

Literature: Sizova, O. S.; Britikova, N. E.; Novitskii, K. Yu.; Shcherbakova, L. I.; Pershin, G. N.; et al. Pharmaceutical Chemistry Journal, 1982 , vol. 16, # 11 p. 834 - 838 Khimiko-Farmatsevticheskii Zhurnal, 1982 , vol. 16, # 11 p. 1338 - 1343

4-chloro-2-phenyl-5H-pyrrolo[3,2-d]pyrimidine-7-carbaldehyde oxime structure

4-chloro-2-phen...

CAS#:84905-64-6

~%

5H-Pyrrolo(3,2-d)pyrimidine-4-sulfonic acid, 7-cyano-2-phenyl-, sodium salt Structure

5H-Pyrrolo(3,2-...

CAS#:84905-76-0

Literature: Sizova, O. S.; Britikova, N. E.; Novitskii, K. Yu.; Shcherbakova, L. I.; Pershin, G. N.; et al. Pharmaceutical Chemistry Journal, 1982 , vol. 16, # 11 p. 834 - 838 Khimiko-Farmatsevticheskii Zhurnal, 1982 , vol. 16, # 11 p. 1338 - 1343

N/A structure

N/A

CAS#:75682-07-4

~%

5H-Pyrrolo(3,2-d)pyrimidine-4-sulfonic acid, 7-cyano-2-phenyl-, sodium salt Structure

5H-Pyrrolo(3,2-...

CAS#:84905-76-0

Literature: Sizova, O. S.; Britikova, N. E.; Novitskii, K. Yu.; Shcherbakova, L. I.; Pershin, G. N.; et al. Pharmaceutical Chemistry Journal, 1982 , vol. 16, # 11 p. 834 - 838 Khimiko-Farmatsevticheskii Zhurnal, 1982 , vol. 16, # 11 p. 1338 - 1343

HS Code	2933990090
Summary	2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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