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9-Methylfluorene

HCID 17299
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
2523-37-7
Standard SMILES
CC1c2ccccc2-c2ccccc21
InChIKey
ZVEJRZRAUYJYCO-UHFFFAOYSA-N
Molecular formula
C14H12
Average molar mass
180.24 g/mol
Monoisotopic mass
180.09390038

Overview

Prisms. (NTP, 1992)

Names & identifiers

Preferred name
9-Methylfluorene
IUPAC
9-methyl-9H-fluorene
English name
9-Methylfluorene
Molecular formula
C14H12
Molecular weight
180.25

Names & synonyms

9-Methylfluorene9-METHYL-9H-FLUORENE2523-37-7Fluorene, 9-methyl-95M10BKB07NSC-10161DTXSID5073957RefChem:108021DTXCID4037241219-750-79H-Fluorene, 9-methyl-MFCD00126475
Show more names
9-methyl-fluoren9-methyl-9h-fluoren9H-fluorene,9-methyl-Talazoparib Impurity 6
9-Methyl-9H-fluorene; NSC 10161CCRIS 4264EINECS 219-750-7NSC 10161UNII-95M10BKB079-methyl fluorene9-Methyl-fluoreneAvibactam Impurity 186

Database identifiers

CAS
2523-37-7
PubChem CID
17299
DTXSID
DTXSID5073957
UNII
95M10BKB07
EC Number
219-750-7
Nikkaji
J69.717F

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
0
Heavy atoms
14
Formal charge
0
Complexity
186

Experimental & physicochemical properties

SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Density1.0263 at 151 °F (NTP, 1992) - Denser than water; will sink
Boiling Point309 to 313 °F at 15 mmHg (NTP, 1992)
Melting Point115 to 117 °F (NTP, 1992)
Physical DescriptionPrisms. (NTP, 1992)

Physicochemical properties

Melting point
46.5 °C · 46.5°C
Boiling point
248.08 °C · 248.08°C (rough estimate)
Density
1.0263 · 1.0263
refractive index
1.61 · 1.6100
storage temp.
Refrigerator
solubility
Chloroform (Slightly), Ethyl Acetate (Slightly)
form
Solid

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Fire HazardsFlash point data for this compound are not available. It is probably combustible. (NTP, 1992)
Reactive GroupHydrocarbons, Aromatic
Reactivity Profile · 1 item

Vigorous reactions, sometimes amounting to explosions, can result from the contact between aromatic hydrocarbons, such as 9-METHYLFLUORENE, and strong oxidizing agents. They can react exothermically with bases and with diazo compounds. Substitution at the benzene nucleus occurs by halogenation (acid catalyst), nitration, sulfonation, and the Friedel-Crafts reaction. This compound is volatile with steam. (NTP, 1992)

Air and Water ReactionsInsoluble in water.
Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety & protection

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1 item

Chemistry & industry

Applications

Uses9-Methylfluorene has been shown to be mutagenic in Salmonella typhimurium TA98 and TA100 in the presence of 9000 X g supernantant from Aroclor-induced rats.

General DescriptionPrisms.

Suppliers34 total

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
上海瀚麟生物科技有限公司183-0212-4410 18302124410 · [email protected]
安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
医恩医疗系统研发(上海)有限公司021-58958002 18930822973 · [email protected]
河南伊诺凯新材料有限公司13290191024 13290191024 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
深圳菲斯生物科技有限公司0755-83725350 13380397412 · [email protected]

Related reactions

9 records
New reaction record
HRID 116202 reaction equation
HRID 116202As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 116590 reaction equation
HRID 116590As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 800547 reaction equation
HRID 800547As productTest data from https://doi.org/10.1039/C8SC04228D
HRID 871190 reaction equation
HRID 871190As productuspto-grants-2015_03
HRID 1918424 reaction equation
HRID 1918424As productuspto-grants-2013_12
HRID 2259277 reaction equation
HRID 2259277As productuspto-grants-1995_12
HRID 2259278 reaction equation
HRID 2259278As reactantuspto-grants-1995_12
HRID 2259279 reaction equation
HRID 2259279As reactantuspto-grants-1995_12
Page 1 of 2

Compound notes

Loading…

On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
color
Orange to Dark Yellow
Henry's Law Constant
9.1 · 9.1×10-2 mol/(m3Pa) at 25℃, Parnis et al. (2015)
Stability
Stable. Combustible. Incompatible with strong oxidizing agents.
InChI
1S/C14H12/c1-10-11-6-2-4-8-13(11)14-9-5-3-7-12(10)14/h2-10H,1H3
InChIKey
ZVEJRZRAUYJYCO-UHFFFAOYSA-N
SMILES
CC1c2ccccc2-c3ccccc13
EWG's Food Scores
1 · 1
FDA UNII
95 M10BKB07 · 95M10BKB07
EPA Substance Registry System
9 · 9-Methylfluorene (2523-37-7)
UNSPSC Code
12352200 · 12352200
NACRES
21 · NA.21
Symbol(GHS)
7 · GHS07,GHS09
Signal word
Warning
Hazard statements
302 · H302-H411
Precautionary statements
264 · P264-P270-P273-P301+P312-P391-P501
Hazard Codes
Xn
Risk Statements
22 · 22-52
RIDADR
3077 · UN 3077 9 / PGIII
WGK Germany
3 · 3
Storage Class
11 · 11 - Combustible Solids
Hazard Classifications
4 OralAquatic · Acute Tox. 4 OralAquatic Chronic 2

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1 item

SMALL SPILLS AND LEAKAGE: Should a spill occur while you are handling this chemical, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with 60-70% ethanol and transfer the dampened material to a suitable container. Use absorbent paper dampened with 60-70% ethanol to pick up any remaining material. Seal the absorbent paper, and any of your clothes, which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with 60-70% ethanol followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Personal Protective Equipment (PPE) · 1 item

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

Safety data

wgk
3
ridadr
UN 3077 9 / PGIII
risk_code
22-52
Signal word
Warning
Symbol(GHS)
GHS07,GHS09
hazard_code
Xn
Storage Class
11 - Combustible Solids
Hazard statements
H302-H411
Hazard Classifications
Acute Tox. 4 OralAquatic Chronic 2
Precautionary statements
P264-P270-P273-P301+P312-P391-P501
常州市水草新材料科技有限公司
0519-86609972; 13861152845 · [email protected]
ZHENGZHOU JIUYI TIME NEW MATERIALS CO,.LTD+8613676922317 · [email protected]
R&D Scientific Inc.+1-2266000236 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海辰烛医药科技有限公司13162380607 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
陕西爱施达尔生物科技有限公司18682931470; 18682931470 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
河南奥诗曼生物科技有限公司13761588971 17719817155 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
徐州砥研医药科技有限公司0516-0516-88997009 18651776937 · [email protected]
河南威梯希化工科技有限公司0371-63284658 18135795563 · [email protected]
Aladdin Scientific[email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
河南科弘生物科技有限公司0371-55969461 18638736641 · [email protected]
Zhengzhou Lingzhiyue Technology Co., Ltd+86-0371-55074660 +86-13523716970 · [email protected]
上海盛袖生物科技有限公司13761144602 · [email protected]