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o-(((2-Mercaptophenyl)imino)methyl)phenol

HCID 76987
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
3449-05-6
Standard SMILES
N=C(c1ccccc1O)c1ccccc1S
InChIKey
KIFGCWWSXJRZRU-UHFFFAOYSA-N
Molecular formula
C13H11NOS
Average molar mass
229.3 g/mol
Monoisotopic mass
229.05613515

Names & identifiers

Preferred name
o-(((2-Mercaptophenyl)imino)methyl)phenol
IUPAC
2-(2-sulfanylbenzenecarboximidoyl)phenol
English name
Salicylideneamino-2-thiophenol
Molecular formula
C13H11NOS
Molecular weight
229.3

Names & synonyms

EINECS 222-370-4o-(((2-Mercaptophenyl)imino)methyl)phenolo-[[(2-mercaptophenyl)imino]methyl]phenolRefChem:855050222-370-43449-05-6SATP【Dotite】Salicylideneamino-2-thiophenol2-(Salicylideneamino)thiophenolN-Salicylidene-2-mercaptoaniline2-(Salicylideneamino)benzenethiolSALICYLIDENEAMINO-2-THIOPHENOL (SATP)
Show more names
2-[[(2-Mercaptophenyl)imino]methyl]phenolN-(2-Mercaptophenyl)-2-hydroxybenzenemethanimine

Database identifiers

CAS
3449-05-6
PubChem CID
76987
EC Number
222-370-4

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
45.1 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
16
Formal charge
0
Complexity
256

Physicochemical properties

storage temp.
Refrigerator
CAS DataBase Reference
3449 · 3449-05-6
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H319-H315-H335
Precautionary statements
264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36/37/39

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 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (97.5%)

Safety data

risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
safety_code
26-36/37/39
Hazard statements
H302-H319-H315-H335
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501

Chemistry & industry

Suppliers14 total

湖南韵邦生物科技股份有限公司0731-88532326 13319508186 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
陕西缔都医药化工有限公司+86-029-81138252 +86-173 9270 1263 · [email protected]
九鼎化学(上海)科技有限公司4009209199 · [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]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]

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Compound notes

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