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2-nitro-1-phenylethanol

HCID 226830
NotesReactions

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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
15990-45-1
Standard SMILES
O=[N+]([O-])CC(O)c1ccccc1
InChIKey
XUEWIQNQPBSCOR-UHFFFAOYSA-N
Molecular formula
C8H9NO3
Average molar mass
167.164 g/mol
Monoisotopic mass
167.05824315

Names & identifiers

Preferred name
2-nitro-1-phenylethanol
IUPAC
2-Nitro-1-phenylethan-1-ol
English name
1-Phenyl-2-nitroethanol
Molecular formula
C8H9NO3
Molecular weight
167.16

Names & synonyms

2-Nitro-1-phenylethanol1-Phenyl-2-nitroethanolBenzenemethanol, α-(nitromethyl)-

Database identifiers

CAS
15990-45-1
PubChem CID
226830
DTXSID
DTXSID00280623
Nikkaji
J597.872F

Properties

Physicochemical properties

Boiling point
317.2 · 317.2±35.0 °C(Predicted)
Density
1.254 · 1.254±0.06 g/cm3(Predicted)
pka
7.98 · 7.98±0.38(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
260 · P260-P280-P301+P310
HazardClass
IRRITANT
HS Code
2906290090 · 2906290090

Safety & regulation

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

Safety data

hs_code
2906290090
Signal word
Warning
Symbol(GHS)
GHS07
hazard_class
IRRITANT
Hazard statements
H302-H315-H319-H335
Precautionary statements
P260-P280-P301+P310

Chemistry & industry

Suppliers11 total

上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
泰州同新生物医药科技有限公司0523-86818997 18652728585 · [email protected]
北京科易通达科技发展有限公司17743531240 · [email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
上海康恩博医药科技有限公司17510465506 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
上海信旗医药科技有限公司+86-21-54098501 · [email protected]

Related reactions

3 records
New reaction record
HRID 505008 reaction equation
HRID 505008As productuspto-grants-2010_08
HRID 1912223 reaction equation
HRID 1912223As productuspto-grants-2013_12
HRID 2312307 reaction equation
HRID 2312307As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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