2,6-Dihydroxybenzonitrile

HCID 93791
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Basic information

CAS
57764-46-2
Standard SMILES
N#Cc1c(O)cccc1O
InChIKey
IEQIEHQVSNLTNH-UHFFFAOYSA-N
Molecular formula
C7H5NO2
Average molar mass
135.12 g/mol
Monoisotopic mass
135.0320284

Names & identifiers

Preferred name
2,6-Dihydroxybenzonitrile
IUPAC
2,6-dihydroxybenzonitrile
English name
2,6-Dihydroxybenzonitrile
Molecular formula
C7H5NO2
Molecular weight
135.12

Names & synonyms

2,6-Dihydroxybenzonitrile57764-46-2EINECS 260-935-7DTXSID90206453RefChem:83252DTXCID90128944260-935-7MFCD02261932Benzonitrile, 2,6-dihydroxy-2,6dihydroxybenzonitrileSCHEMBL2285228SCHEMBL28642879
Show more names
SY237965DB-127480CS-0373219NS00033783Y1471325E-6002

Database identifiers

CAS
57764-46-2
PubChem CID
93791
DTXSID
DTXSID90206453
EC Number
260-935-7
Nikkaji
J296.784G

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
64.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
10

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338
Risk Statements
20 · 20/21/22-36/37/38
Safety Statements
26 · 26-36/37/39

Safety & regulation

Safety data

ridadr
3276
risk_code
20/21/22-36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
safety_code
26-36/37/39
Hazard statements
H302-H315-H319-H335

Chemistry & industry

Suppliers11 total

江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
上海启智医药科技有限公司021-54849683 13601642561 · [email protected]
贵州易妥化学科技有限公司18628235590 · [email protected]
上海创焰化学科技有限公司021-11111111 11111111111 · [email protected]
湖北齐飞医药化工有限公司027-59322506 18071128681 · [email protected]

Related reactions

10 records
New reaction record

Compound notes

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