3-Deazaguanine

Modify Date: 2025-08-25 14:25:17

3-Deazaguanine Structure
3-Deazaguanine structure
Common Name 3-Deazaguanine
CAS Number 41729-52-6 Molecular Weight 150.13800
Density 1.513g/cm3 Boiling Point 718ºC at 760 mmHg
Molecular Formula C6H6N4O Melting Point N/A
MSDS N/A Flash Point 388ºC

 Names

Name 6-amino-1,5-dihydroimidazo[4,5-c]pyridin-4-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.513g/cm3
Boiling Point 718ºC at 760 mmHg
Molecular Formula C6H6N4O
Molecular Weight 150.13800
Flash Point 388ºC
Exact Mass 150.05400
PSA 87.56000
LogP 0.41460
Index of Refraction 1.682
InChIKey KXBCLNRMQPRVTP-UHFFFAOYSA-N
SMILES Nc1cc2[nH]cnc2c(=O)[nH]1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NJ5830880
CHEMICAL NAME :
4H-Imidazo(4,5-c)pyridin-4-one, 6-amino-1,5-dihydro-
CAS REGISTRY NUMBER :
41729-52-6
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C6-H6-N4-O
MOLECULAR WEIGHT :
150.16
WISWESSER LINE NOTATION :
T56 BN DM FVMJ HZ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
DNA inhibition
TEST SYSTEM :
Rodent - mouse Leukocyte
DOSE/DURATION :
50 umol/L
REFERENCE :
CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 42,4039,1982

 Safety Information

HS Code 2933990090

 Precursor & DownStream

Precursor  1

DownStream  0

 Customs

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%

 Synonyms

Dezaguanina [Spanish]
6-Aminoimidazo(4,5-c)pyridin-4(5H)-one
6-Amino-imidazo<4,5-c>pyridin-4-on
ICN 4221
3-Deazaguanine
Dezaguaninum [Latin]
3-Desaza-guanin
6-amino-1,5-dihydro-imidazo[4,5-c]pyridin-4-one
Dezaguanine
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