Benzoic acid, 2-amino-5-iodo-

HCID 72911CAS 5326-47-6
Substructure searchFind similar structures

Basic information

Standard SMILES
Nc1ccc(I)cc1C(=O)O
InChIKey
GOLGILSVWFKZRQ-UHFFFAOYSA-N
Molecular formula
C7H6INO2
Average molar mass
263.03 g/mol
Monoisotopic mass
262.94432643

Names & identifiers

Preferred name
Benzoic acid, 2-amino-5-iodo-
IUPAC
2-amino-5-iodobenzoic acid
English name
2-Amino-5-iodobenzoic acid
Molecular formula
C7H6INO2
Molecular weight
263.03

Names & synonyms

2-Amino-5-iodobenzoic acid5326-47-6Benzoic acid, 2-amino-5-iodo-Anthranilic acid, 5-iodo-5-Iodoanthranil acidNSC 302EINECS 226-205-7BRN 06390294-14-00-01084 (Beilstein Handbook Reference)RefChem:565514Anthranilic acid, 5-iodo-(8CI)226-205-7
Show more names
TIMTEC-BB SBB0010065-Iodoanthanilic acid5-iodo-anthranilicaci2-Amino-5-iodobenzoic5-Iodoanthranillic acid5-IodoanthranilicAcid>5-lodo anthranillic acid2-amino-5-iodo-benzoicaci
InChI=1/C7H6INO2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,9H2,(H,10,115-Iodoanthranilic acid2-amino-5-iodo-benzoic acidMFCD00007849PM5QRB3P44NSC-302544423-71-42-Amino-5-iodobenzoicacid

Database identifiers

CAS
5326-47-6
PubChem CID
72911
DTXSID
DTXSID1063776
UNII
PM5QRB3P44
EC Number
226-205-7
Nikkaji
J80.998E

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
63.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
11

Experimental & physicochemical properties

LogP2.67

Physicochemical properties

Melting point
219 · 219-221 °C (dec.) (lit.)
Boiling point
383.2 · 383.2±37.0 °C(Predicted)
Density
1.8886 · 1.8886 (estimate)
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
solubility
DMSO (Slightly), Methanol (Slightly)
pka
4.59 · 4.59±0.10(Predicted)

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 49 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

PPE
dust mask type N95 (US), Eyeshields, Gloves
wgk
3
tsca
TSCA listed
rtecs
DG2802000
hs_code
29224995
risk_code
36/37/38

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationBenzoic acid, 2-amino-5-iodo-: INACTIVE

Applications

Uses2-Amino-5-iodobenzoic acid is used in wide range of medicals industrial applications as well as in human and animal nutrition products such as pharmaceutical intermediates, polarizing films for Liquid Crystal Display (LCD) chemicals.

Upstream & downstream products

Suppliers50 total

杭州创引化工科技有限公司0571-87086220 13516718938 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
上海赫文斯化工有限公司15721252604 17321035817 · [email protected]

Related reactions

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Linked notes

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