Name: Name:(3-Cyanophenoxy)acetic acid
Brand: AABLOCKS
SKU: AA002GHE
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA002GHE

Chemical Name: (3-Cyanophenoxy)acetic acid

CAS Number: 1879-58-9

Molecular Formula: C9H7NO3

Molecular Weight: 177.1568

MDL Number: MFCD00516888

SMILES: N#Cc1cccc(c1)OCC(=O)O

Properties

BP: 352.235°C at 760 mmHg

Form: Solid

Refractive Index: 1.5200 (estimate)

Storage: Keep in dry area;2-8℃;

Complexity: 230

Covalently-Bonded Unit Count: 1

Heavy Atom Count: 13

Hydrogen Bond Acceptor Count: 4

Hydrogen Bond Donor Count: 1

Rotatable Bond Count: 3

XLogP3: 0.9

Downstream Synthesis Route

873-62-1

79-11-8

1879-58-9

[1]Hayes;Branch[JournaloftheAmericanChemicalSociety,1943,vol.65,p.1555]

1879-58-9

619-45-4

308288-85-9

[1]Su,Ting;Wu,Yanhong;Doughan,Brandon;Kane-Maguire,Kim;Marlowe,CharlesK;Kanter,JamesP;Woolfrey,John;Huang,Brian;Wong,Paul;Sinha,Uma;Park,Gary;Malinowski,John;Hollenbach,Stan;Scarborough,RobertM;Zhu,Bing-Yan[BioorganicandMedicinalChemistryLetters,2001,vol.11,#17,p.2279-2282]

308272-30-2

1879-58-9

[1]Su,Ting;Wu,Yanhong;Doughan,Brandon;Kane-Maguire,Kim;Marlowe,CharlesK;Kanter,JamesP;Woolfrey,John;Huang,Brian;Wong,Paul;Sinha,Uma;Park,Gary;Malinowski,John;Hollenbach,Stan;Scarborough,RobertM;Zhu,Bing-Yan[BioorganicandMedicinalChemistryLetters,2001,vol.11,#17,p.2279-2282]

873-62-1

1879-58-9

[1]Su,Ting;Wu,Yanhong;Doughan,Brandon;Kane-Maguire,Kim;Marlowe,CharlesK;Kanter,JamesP;Woolfrey,John;Huang,Brian;Wong,Paul;Sinha,Uma;Park,Gary;Malinowski,John;Hollenbach,Stan;Scarborough,RobertM;Zhu,Bing-Yan[BioorganicandMedicinalChemistryLetters,2001,vol.11,#17,p.2279-2282]

[2]Tran,KimT.;Pallesen,JakobS.;Solbak,SaraM.;Narayanan,Dilip;Baig,Amina;Zang,Jie;Aguayo-Orozco,Alejandro;Carmona,RosaM.C.;Garcia,AnthonyD.;Bach,Anders[JournalofMedicinalChemistry,2019,vol.62,#17,p.8028-8052]

1879-58-9 | (3-Cyanophenoxy)acetic acid