Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide

HCID 145992CAS 7072-40-4

Basic information

Standard SMILES
Br.Br.N=C(N)SCCCN
InChIKey
JBTDFRNUVWFUGL-UHFFFAOYSA-N
Molecular formula
C4H13Br2N3S
Average molar mass
295.04 g/mol
Monoisotopic mass
292.91969262

Names & identifiers

Preferred name
Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide
IUPAC
3-aminopropyl carbamimidothioate;dihydrobromide
English name
S-(3-Aminopropyl)isothiourea dihydrobromide
Molecular formula
C4H13Br2N3S
Molecular weight
295.03912

Names & synonyms

Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromideRefChem:1097122APT (radioprotective)7072-40-4S-(3-Aminopropyl)-ITU dihydrobromideS-(3-aminopropyl)isothiourea dihydrobromide3-aminopropyl carbamimidothioate dihydrobromide3-aminopropyl carbamimidothioate;dihydrobromide3-Aminopropylisothiourea dihydrobromideS-(3-Aminopropyl)thiuronium dihydrobromide3-Aminopropylisothiuronium bromide hydrobromideA 21818
Show more names
NSC-628573-aminopropylthiopseudoureadihydrobromideS-(3-aminopropyl)isothioureadihydrobromidepurum
Carbamimidothioic acid, 3-aminopropyl ester, dihydrobromide[(3-aminopropyl)sulfanyl]methanimidamide dihydrobromideNSC 628573-Aminopropylthiopseudourea dihydrobromideS,gaama-Aminopropylisothiuronium bromide hydrobromideSCHEMBL4434174Carbamimidothioic acid, 3-aminopropyl ester,dihydrobromideJBTDFRNUVWFUGL-UHFFFAOYSA-N

Database identifiers

CAS
7072-40-4
PubChem CID
145992
DTXSID
DTXSID501373805

Properties

Computed structural properties

Topological polar surface area
101 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
10

Physicochemical properties

storage temp.
20 °C · −20°C
Safety Statements
22 · 22-24/25
RTECS
535000 · UM0535000

Safety & regulation

Safety data

rtecs
UM0535000
safety_code
22-24/25

Chemistry & industry

Suppliers7 total

上海钰博生物科技有限公司021-60514606 18321282235 · [email protected]
南京美博生物科技有限公司025-58619198 · [email protected]
上海贺康生物技术有限公司17721021104 18939837085 · [email protected]
上海碧咸医药科技有限公司13816613772 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]

Related reactions

5 records

Linked notes

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