2-Nitro-3-methyl-5,6,7,8-tetrahydronaphtho(2,3-b)furan

Modify Date: 2025-10-29 12:57:10

2-Nitro-3-methyl-5,6,7,8-tetrahydronaphtho(2,3-b)furan Structure
2-Nitro-3-methyl-5,6,7,8-tetrahydronaphtho(2,3-b)furan structure
Common Name 2-Nitro-3-methyl-5,6,7,8-tetrahydronaphtho(2,3-b)furan
CAS Number 86295-62-7 Molecular Weight 231.24700
Density 1.28g/cm3 Boiling Point 375.4ºC at 760 mmHg
Molecular Formula C13H13NO3 Melting Point N/A
MSDS N/A Flash Point 180.8ºC

 Names

Name nitro-2 methyl-3 tetrahydro-5,6,7,8 naphto<2,3-b>furanne
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.28g/cm3
Boiling Point 375.4ºC at 760 mmHg
Molecular Formula C13H13NO3
Molecular Weight 231.24700
Flash Point 180.8ºC
Exact Mass 231.09000
PSA 58.96000
LogP 4.05140
Index of Refraction 1.608
InChIKey QGUPZAVUADVRDG-UHFFFAOYSA-N
SMILES Cc1c([N+](=O)[O-])oc2cc3c(cc12)CCCC3

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QL0846000
CHEMICAL NAME :
Naphtho(2,3-b)furan, 5,6,7,8-tetrahydro-3-methyl-2-nitro-
CAS REGISTRY NUMBER :
86295-62-7
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C13-H13-N-O3
MOLECULAR WEIGHT :
231.27

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Mutation test systems - not otherwise specified
TEST SYSTEM :
Bacteria - Escherichia coli
DOSE/DURATION :
1 nmol/tube
REFERENCE :
MUTAEX Mutagenesis. (Oxford Univ. Press, Pinkhill House, Southfield Road, Eynsham, Oxford OX8 1JJ, UK) V.1- 1986- Volume(issue)/page/year: 1,217,1986

 Synthetic Route

 Bioassay

View more

Name: Genotoxicity (SOSIP) on Escherichia coli PQ37 (SOS induction potential data, as a mea...
Source: ChEMBL
Target: Escherichia coli
External Id: CHEMBL673967
Name: Mutagenicity in Salmonella Typhimurium TA100 was determined
Source: ChEMBL
Target: Salmonella enterica subsp. enterica serovar Typhimurium
External Id: CHEMBL806458
Name: Mutagenicity in Salmonella Typhimurium TA98 was determined
Source: ChEMBL
Target: Salmonella enterica subsp. enterica serovar Typhimurium
External Id: CHEMBL806460
Name: Calculated partition coefficient (clogP)
Source: ChEMBL
Target: N/A
External Id: CHEMBL631675
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 Synonyms

3-methyl-2-nitro-5,6,7,8-tetrahydronaphtho< 2,3-b>3-methyl-2-nitro-5,6,7,8-tetrahydronaphtho<2,3-b>furan
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